| SpectraBase Compound ID | 8ZTFQf6AAqc |
|---|---|
| InChI | InChI=1S/C15H26O/c1-10-5-8-15(16)13(2,3)11-6-7-14(15,4)12(10)9-11/h10-12,16H,5-9H2,1-4H3/t10?,11-,12+,14+,15-/m1/s1 |
| InChIKey | GGHMUJBZYLPWFD-ZZZRFXDASA-N |
| Mol Weight | 222.37 g/mol |
| Molecular Formula | C15H26O |
| Exact Mass | 222.198365 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | A4oKcY2ScX3 |
|---|---|
| Name | Patchouli alcohol |
| CAS Registry Number | 5986-55-0 |
| Comments | Structure changed after expert review |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H26O |
| InChI | InChI=1S/C15H26O/c1-10-5-8-15(16)13(2,3)11-6-7-14(15,4)12(10)9-11/h10-12,16H,5-9H2,1-4H3/t10?,11-,12+,14+,15-/m1/s1 |
| InChIKey | GGHMUJBZYLPWFD-ZZZRFXDASA-N |
| Molecular Weight | 222.372 g/mol |
| SMILES | O[C@@]12C([C@@]3(CC[C@]2([C@@](C3)(C(CC1)C)[H])C)[H])(C)C |
| SPLASH | splash10-008d-9510000000-f1290ef53ed1dfddee98 |
| Source of Spectrum | LQ-1992-2151-0 |
| Synonyms | 1,6-Methanonaphthalen-1(2H)-ol, octahydro-4,8a,9,9-tetramethyl-, [1R-(1.alpha.,4.beta.,4a.alpha.,6.beta.,8a.alpha.)]- (1R,4S,4aS,6R,8aS)-4,8a,9,9-Tetramethyldecahydro-1,6-methanonaphthalen-1-ol Patchoulic alcohol (-)-Patchouli alcohol Patchoulol (-)-Patchoulol 1,6-Methanonaphthalen-1(2H)-ol, octahydro-4,8a,9,9-tetramethyl-, (1.alpha.,4.beta.,4a.alpha.,6.beta.,8a.alpha.)- Patchoulanol 4,8a,9,9-tetramethyldecahydro-1,6-methanonaphthalen-1-ol |
| Wiley ID | 1223255 |