| { |
| "limonene": { |
| "cas": "138-86-3", |
| "smiles": "CC1=CCC(CC1)C(=C)C", |
| "family": "citrus_fresh", |
| "substantivity_log10": 0.6021, |
| "vp": 206.64967040000002, |
| "name": "LIMONENE" |
| }, |
| "citral": { |
| "cas": "5392-40-5", |
| "smiles": "CC(=CCC/C(=C/C=O)/C)C", |
| "family": "citrus_fresh", |
| "substantivity_log10": 1.0792, |
| "vp": 666.61184, |
| "name": "CITRAL" |
| }, |
| "linalool": { |
| "cas": "78-70-6", |
| "smiles": "CC(=CCCC(C)(C=C)O)C", |
| "family": "aromatic_herbal", |
| "substantivity_log10": 0.5455479099913592, |
| "vp": 2.1331583999999997, |
| "name": "Linalool" |
| }, |
| "dihydromyrcenol": { |
| "cas": "18479-58-8", |
| "smiles": "CC(CCCC(C)(C)O)C=C", |
| "family": "citrus_fresh", |
| "substantivity_log10": 1.2041, |
| "vp": null, |
| "name": "Dihydromyrcenol" |
| }, |
| "linalyl acetate": { |
| "cas": "115-95-7", |
| "smiles": "CC(=CCCC(C)(C=C)OC(=O)C)C", |
| "family": "aromatic_herbal", |
| "substantivity_log10": 1.301, |
| "vp": 14.798782848000002, |
| "name": "LINALYL ACETATE" |
| }, |
| "geraniol": { |
| "cas": "106-24-1", |
| "smiles": "CC(=CCCC(=CCO)C)C", |
| "family": "floral_sweet", |
| "substantivity_log10": 0.8714117512565434, |
| "vp": 2.7997704, |
| "name": "GERANIOL" |
| }, |
| "citronellol": { |
| "cas": "106-22-9", |
| "smiles": "CC(CCC=C(C)C)CCO", |
| "family": "floral_sweet", |
| "substantivity_log10": 0.7483857251459054, |
| "vp": 1.0, |
| "name": "Citronellol" |
| }, |
| "methyl anthranilate": { |
| "cas": "134-20-3", |
| "smiles": "COC(=O)C1=CC=CC=C1N", |
| "family": "citrus_fresh", |
| "substantivity_log10": 1.9445, |
| "vp": 3.6130361728000002, |
| "name": "METHYL ANTHRANILATE" |
| }, |
| "phenylethyl alcohol": { |
| "cas": "60-12-8", |
| "smiles": "C1=CC=C(C=C1)CCO", |
| "family": "floral_sweet", |
| "substantivity_log10": 1.5051, |
| "vp": 11.5723815424, |
| "name": "PHENYLETHYL ALCOHOL" |
| }, |
| "hedione": { |
| "cas": "24851-98-7", |
| "smiles": "CCCCCC1C(CCC1=O)CC(=O)OC", |
| "family": "floral_sweet", |
| "substantivity_log10": 1.4042099308515923, |
| "vp": 0.13332239999999998, |
| "name": "Methyl dihydrojasmonate" |
| }, |
| "benzyl acetate": { |
| "cas": "140-11-4", |
| "smiles": "CC(=O)OCC1=CC=CC=C1", |
| "family": "floral_sweet", |
| "substantivity_log10": 0.6021, |
| "vp": 23.598059136, |
| "name": "BENZYL ACETATE" |
| }, |
| "hydroxycitronellal": { |
| "cas": "107-75-5", |
| "smiles": "CC(CCCC(C)(C)O)CC=O", |
| "family": "floral_sweet", |
| "substantivity_log10": 2.3385, |
| "vp": 0.39996719999999997, |
| "name": "Hydroxycitronellal Extra" |
| }, |
| "lyral": { |
| "cas": "31906-04-4", |
| "smiles": "CC1CCC(C(C)(C)O)CC1CC=O", |
| "family": "floral_sweet", |
| "substantivity_log10": 1.6585012443829896, |
| "vp": null, |
| "name": "Lyral / HMPCC" |
| }, |
| "lilial": { |
| "cas": "80-54-6", |
| "smiles": "CC(C)(C)c1ccc(CC(C)C=O)cc1", |
| "family": "floral_sweet", |
| "substantivity_log10": 1.8513564949232542, |
| "vp": 0.666612, |
| "name": "Lilial" |
| }, |
| "rose oxide": { |
| "cas": "16409-43-1", |
| "smiles": "CC1CCOC(C1)C=C(C)C", |
| "family": "floral_sweet", |
| "substantivity_log10": 0.0, |
| "vp": 73.4606424, |
| "name": "ROSE OXIDE" |
| }, |
| "alpha-isomethyl ionone": { |
| "cas": "127-51-5", |
| "smiles": "CC1=CCCC(C1C=C(C)C(=O)C)(C)C", |
| "family": "floral_sweet", |
| "substantivity_log10": 1.4174858010807574, |
| "vp": 0.7999343999999999, |
| "name": "3-Methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-one" |
| }, |
| "geranyl acetate": { |
| "cas": "105-87-3", |
| "smiles": "CC(=CCC/C(=C/COC(=O)C)/C)C", |
| "family": "floral_sweet", |
| "substantivity_log10": 1.3802, |
| "vp": 2.6664473600000003, |
| "name": "GERANYL ACETATE" |
| }, |
| "citronellyl acetate": { |
| "cas": "150-84-5", |
| "smiles": "CC(CCC=C(C)C)CCOC(=O)C", |
| "family": "floral_sweet", |
| "substantivity_log10": 0.9646004047724122, |
| "vp": 1.0, |
| "name": "Citronellyl acetate" |
| }, |
| "benzyl salicylate": { |
| "cas": "118-58-1", |
| "smiles": "C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2O", |
| "family": "floral_sweet", |
| "substantivity_log10": 0.8315462608844187, |
| "vp": 0.022664807999999998, |
| "name": "BENZYL SALICYLATE" |
| }, |
| "hexyl cinnamic aldehyde": { |
| "cas": "101-86-0", |
| "smiles": "CCCCCC/C(=C/C1=CC=CC=C1)/C=O", |
| "family": "floral_sweet", |
| "substantivity_log10": 2.6021, |
| "vp": null, |
| "name": "Hexyl Cinnamic Aldehyde" |
| }, |
| "iso e super": { |
| "cas": "54452-50-3", |
| "smiles": "CC(C=O)CC1CC(C)CCC1C(C)C", |
| "family": "woody_amber", |
| "substantivity_log10": 1.7687510683883427, |
| "vp": null, |
| "name": "Iso E Super (OTNE)" |
| }, |
| "cedryl acetate": { |
| "cas": "77-54-3", |
| "smiles": "C[C@@H]1CC[C@@H]2[C@]13CC[C@@]([C@H](C3)C2(C)C)(C)OC(=O)C", |
| "family": "woody_amber", |
| "substantivity_log10": 2.6021, |
| "vp": null, |
| "name": "CEDRYL ACETATE" |
| }, |
| "vetiveryl acetate": { |
| "cas": "117-98-6", |
| "smiles": "CC(=O)OC1CC2CCC(C)C(C)C2C1", |
| "family": "woody_amber", |
| "substantivity_log10": 1.5860939931912441, |
| "vp": null, |
| "name": "Vetiveryl acetate" |
| }, |
| "ambroxan": { |
| "cas": "3738-00-9", |
| "smiles": "CC1(CCCC2(C1CCC3(C2CCO3)C)C)C", |
| "family": "woody_amber", |
| "substantivity_log10": 2.8751, |
| "vp": null, |
| "name": "Ambroxan Crystals" |
| }, |
| "cashmeran": { |
| "cas": "33704-61-9", |
| "smiles": "CC1C(C2=C(C1(C)C)C(=O)CCC2)(C)C", |
| "family": "woody_amber", |
| "substantivity_log10": 1.8005083423140649, |
| "vp": 0.39996719999999997, |
| "name": "Cashmeran" |
| }, |
| "bacdanol": { |
| "cas": "28219-60-5", |
| "smiles": "CC1=CCC(C1(C)C)CC=C(C)CO", |
| "family": "woody_amber", |
| "substantivity_log10": 2.6021, |
| "vp": null, |
| "name": "BACDANOL\u00ae(IFF)" |
| }, |
| "eugenol": { |
| "cas": "97-53-0", |
| "smiles": "COC1=C(C=CC(=C1)CC=C)O", |
| "family": "woody_amber", |
| "substantivity_log10": 1.4864115829418707, |
| "vp": 1.333224, |
| "name": "eugenol" |
| }, |
| "guaiacol": { |
| "cas": "90-05-1", |
| "smiles": "COC1=CC=CC=C1O", |
| "family": "woody_amber", |
| "substantivity_log10": 0.40106539759166526, |
| "vp": 5.0, |
| "name": "guaiacol" |
| }, |
| "vanillin": { |
| "cas": "121-33-5", |
| "smiles": "COC1=C(C=CC(=C1)C=O)O", |
| "family": "gourmand", |
| "substantivity_log10": 1.832999555159019, |
| "vp": 0.26664479999999996, |
| "name": "vanillin" |
| }, |
| "ethyl vanillin": { |
| "cas": "121-32-4", |
| "smiles": "CCOC1=C(C=CC(=C1)C=O)O", |
| "family": "gourmand", |
| "substantivity_log10": 2.4314, |
| "vp": 0.0013865526272000001, |
| "name": "ETHYL VANILLIN" |
| }, |
| "ethyl maltol": { |
| "cas": "4940-11-8", |
| "smiles": "CCC1=C(C(=O)C=CO1)O", |
| "family": "gourmand", |
| "substantivity_log10": 2.5563, |
| "vp": null, |
| "name": "Ethyl Maltol" |
| }, |
| "maltol": { |
| "cas": "118-71-8", |
| "smiles": "CC1=C(C(=O)C=CO1)O", |
| "family": "gourmand", |
| "substantivity_log10": 2.3424, |
| "vp": 0.043463091968, |
| "name": "MALTOL" |
| }, |
| "coumarin": { |
| "cas": "91-64-5", |
| "smiles": "O=c1ccc2ccccc2o1", |
| "family": "aromatic_herbal", |
| "substantivity_log10": 1.6355232646922482, |
| "vp": 13.332239999999999, |
| "name": "Coumarin" |
| }, |
| "benzaldehyde": { |
| "cas": "100-52-7", |
| "smiles": "O=Cc1ccccc1", |
| "family": "gourmand", |
| "substantivity_log10": 1.6471390248139453, |
| "vp": 16.931940736, |
| "name": "benzaldehyde" |
| }, |
| "cinnamaldehyde": { |
| "cas": "104-55-2", |
| "smiles": "C1=CC=C(C=C1)C=CC=O", |
| "family": "gourmand", |
| "substantivity_log10": 1.6543392385436038, |
| "vp": 3.8530164352000007, |
| "name": "cinnamaldehyde" |
| }, |
| "cinnamyl alcohol": { |
| "cas": "104-54-1", |
| "smiles": "C1=CC=C(C=C1)C=CCO", |
| "family": "gourmand", |
| "substantivity_log10": 1.599995756958758, |
| "vp": 1.0, |
| "name": "cinnamyl alcohol" |
| }, |
| "heliotropin": { |
| "cas": "120-57-0", |
| "smiles": "C1OC2=C(O1)C=C(C=C2)C=O", |
| "family": "gourmand", |
| "substantivity_log10": 2.3263, |
| "vp": 1.3332236800000001, |
| "name": "Heliotropin" |
| }, |
| "eucalyptol": { |
| "cas": "470-82-6", |
| "smiles": "CC1(C2CCC(O1)(CC2)C)C", |
| "family": "aromatic_herbal", |
| "substantivity_log10": 0.6021, |
| "vp": 253.31249920000002, |
| "name": "EUCALYPTOL" |
| }, |
| "camphor": { |
| "cas": "76-22-2", |
| "smiles": "CC1(C2CCC1(C(=O)C2)C)C", |
| "family": "aromatic_herbal", |
| "substantivity_log10": 1.1721889836355803, |
| "vp": 10.0, |
| "name": "camphor" |
| }, |
| "menthol": { |
| "cas": "89-78-1", |
| "smiles": "CC1CCC(C(C)C)C(O)C1", |
| "family": "aromatic_herbal", |
| "substantivity_log10": 1.2957391198165362, |
| "vp": 8.492634841600001, |
| "name": "Menthol" |
| }, |
| "veramoss": { |
| "cas": "4707-47-5", |
| "smiles": "COC(=O)c1c(C)cc(O)c(C)c1O", |
| "family": "aromatic_herbal", |
| "substantivity_log10": 1.7707364548808913, |
| "vp": null, |
| "name": "Veramoss / Evernyl" |
| }, |
| "galaxolide": { |
| "cas": "1222-05-5", |
| "smiles": "CC1COCC2=CC3=C(C=C12)C(C(C3(C)C)C)(C)C", |
| "family": "musk_clean", |
| "substantivity_log10": 1.7542117099122565, |
| "vp": 0.05519547359999999, |
| "name": "Galaxolide" |
| }, |
| "ambrettolide": { |
| "cas": "123-69-3", |
| "smiles": "C1CCCCOC(=O)CCCCC/C=C\\CCC1", |
| "family": "musk_clean", |
| "substantivity_log10": null, |
| "vp": null, |
| "name": "AMBRETTOLIDE" |
| }, |
| "ethylene brassylate": { |
| "cas": "105-95-3", |
| "smiles": "C1CCCCCC(=O)OCCOC(=O)CCCCC1", |
| "family": "musk_clean", |
| "substantivity_log10": 1.7015357858134117, |
| "vp": 0.003, |
| "name": "Ethylene brassylate" |
| }, |
| "exaltolide": { |
| "cas": "106-02-5", |
| "smiles": "C1CCCCCCCOC(=O)CCCCCC1", |
| "family": "musk_clean", |
| "substantivity_log10": 2.699, |
| "vp": null, |
| "name": "Exaltolide" |
| }, |
| "habanolide": { |
| "cas": "111879-80-2", |
| "smiles": "C1CCCC/C=C/CCCOC(=O)CCCC1", |
| "family": "musk_clean", |
| "substantivity_log10": 2.5263, |
| "vp": null, |
| "name": "HABANOLIDE\u00ae(Firmenich)" |
| }, |
| "musk ketone": { |
| "cas": "81-14-1", |
| "smiles": "CC1=C(C(=C(C(=C1[N+](=O)[O-])C(C)(C)C)[N+](=O)[O-])C)C(=O)C", |
| "family": "musk_clean", |
| "substantivity_log10": 2.7782, |
| "vp": 3.99967104e-05, |
| "name": "MUSK KETONE" |
| }, |
| "cis-3-hexenol": { |
| "cas": "544-12-7", |
| "smiles": "CC/C=C\\CCO", |
| "family": "green", |
| "substantivity_log10": 0.6021, |
| "vp": null, |
| "name": "cis-3-HEXENOL" |
| }, |
| "cis-3-hexenyl acetate": { |
| "cas": "3681-71-8", |
| "smiles": "CC/C=C\\CCOC(=O)C", |
| "family": "green", |
| "substantivity_log10": null, |
| "vp": null, |
| "name": "Cis 3 Hexenyl Acetate 1%" |
| }, |
| "stemone": { |
| "cas": "22457-23-4", |
| "smiles": "CCC(C)CC(=NO)CC", |
| "family": "green", |
| "substantivity_log10": 1.2041, |
| "vp": null, |
| "name": "Stemone" |
| }, |
| "hexenyl salicylate": { |
| "cas": "65405-77-8", |
| "smiles": "CC/C=C/CCOC(=O)C1=CC=CC=C1O", |
| "family": "green", |
| "substantivity_log10": 2.3345, |
| "vp": 0.0327973104, |
| "name": "cis-3-HEXENYL SALICYLATE" |
| } |
| } |
