SpectraBase Spectrum ID |
4cAtmiVkPlt |
Name |
Occidol |
CAS Registry Number |
5986-36-7 |
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/c1-10-5-6-11(2)14-9-12(15(3,4)16)7-8-13(10)14/h5-6,12,16H,7-9H2,1-4H3/t12-/m1/s1 |
InChIKey |
AFBBWQXTLZVDEE-GFCCVEGCSA-N |
Molecular Weight |
218.340 g/mol |
Nominal Mass |
218 u |
Number of Peaks |
139 |
SMILES |
OC([C@@]1(CCc2c(ccc(c2C1)C)C)[H])(C)C |
SPLASH |
splash10-0a4i-1910000000-d948b08bfde9e44e441c |
Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
Wiley ID |
RA001054 |