| SpectraBase Compound ID | 9BdChC3Va9e |
|---|---|
| InChI | InChI=1S/C15H22O/c1-9-8-10(16)12-13-11(9)15(12,4)7-5-6-14(13,2)3/h8,11-13H,5-7H2,1-4H3/t11-,12+,13-,15+/m1/s1 |
| InChIKey | KTPOZFYJWLGJGH-COMQUAJESA-N |
| Mol Weight | 218.34 g/mol |
| Molecular Formula | C15H22O |
| Exact Mass | 218.167065 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Dm93QSKHwb4 |
|---|---|
| Name | Longiverbenone |
| Alternate Name(s) | Vulgarone B |
| CAS Registry Number | 64180-68-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H22O |
| InChI | InChI=1S/C15H22O/c1-9-8-10(16)12-13-11(9)15(12,4)7-5-6-14(13,2)3/h8,11-13H,5-7H2,1-4H3/t11-,12+,13-,15+/m1/s1 |
| InChIKey | KTPOZFYJWLGJGH-COMQUAJESA-N |
| Molecular Weight | 218.340 g/mol |
| SMILES | [C@]12([C@@]3(C(C)=CC([C@]2([C@@]3(C(C)(C)CCC1)[H])[H])=O)[H])C |
| SPLASH | splash10-052b-0910000000-ab4361049e581fe14451 |
| Source of Spectrum | F-34-2898-0 |
| Wiley ID | 1218269 |