| SpectraBase Spectrum ID |
mNszeI0AtH |
| Name |
Davanone-2-ol |
| CAS Registry Number |
54783-66-3 |
| 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 |
252.172544630 u |
| Formula |
C15H24O3 |
| 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/C15H24O3/c1-6-15(5)10-8-13(18-15)11(2)12(16)7-9-14(3,4)17/h6-7,9,11,13,17H,1,8,10H2,2-5H3/b9-7+/t11-,13-,15-/m0/s1 |
| InChIKey |
WQUKMIHCFQFPQG-LEMVAQLRSA-N |
| Molecular Weight |
252.354 g/mol |
| Nominal Mass |
252 u |
| Number of Peaks |
116 |
| SMILES |
OC(\C=C\C([C@@]([C@@]1(CC[C@@](O1)(C=C)C)[H])(C)[H])=O)(C)C |
| SPLASH |
splash10-0006-9200000000-36441a1f91735188e722 |
| Source |
ex ARMOISE A DAVANONE ex GUY COLLIN |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000460 |
