| SpectraBase Spectrum ID |
Bs8mkQYmAY5 |
| Name |
Vetivone |
| CAS Registry Number |
15764-04-2 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
218.167065327 u |
| Formula |
C15H22O |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness) |
| GC Oven Program |
60 °C to 246 °C at 3 °C/min. |
| InChI |
InChI=1S/C15H22O/c1-10(2)12-5-6-13-8-14(16)7-11(3)15(13,4)9-12/h8,11H,5-7,9H2,1-4H3/t11-,15+/m1/s1 |
| InChIKey |
NIIPDXITZPFFTE-ABAIWWIYSA-N |
| Molecular Weight |
218.340 g/mol |
| Nominal Mass |
218 u |
| Number of Peaks |
170 |
| SMILES |
C1(CCC=2[C@@](C1)([C@@](CC(C2)=O)(C)[H])C)=C(C)C |
| SPLASH |
splash10-000i-4920000000-24a1c9d182a520aa4ca9 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001397 |
![(4R,4aS)-(+)-4,4a-Dimethyl-6-isopropylidene-4,4a,5,6,7,8-hexahydro(3H)-naphthalen-2-one [(+)-.alpha.-vetivone]](/api/spectrum/Bs8mkQYmAY5/structure.png?h=300&w=458 "(4R,4aS)-(+)-4,4a-Dimethyl-6-isopropylidene-4,4a,5,6,7,8-hexahydro(3H)-naphthalen-2-one [(+)-.alpha.-vetivone]")
