SpectraBase Spectrum ID |
BwZcixQx1s0 |
Name |
Germacrone |
Source of Sample |
SAFC Cat.no. W276618 |
CAS Registry Number |
6902-91-6 |
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 |
InChI |
InChI=1S/C15H22O/c1-11(2)14-9-8-12(3)6-5-7-13(4)10-15(14)16/h7-8H,5-6,9-10H2,1-4H3/b12-8+,13-7+ |
InChIKey |
CAULGCQHVOVVRN-SWZPTJTJSA-N |
Molecular Weight |
218.340 g/mol |
Number of Peaks |
50 |
RI1 |
1698 |
RI2 |
1375 |
SMILES |
C1C\C(=C\CC(C(C\C(=C\1)C)=O)=C(C)C)C |
SPLASH |
splash10-0a4u-7900000000-f5ce53a3f0e9c2fa0a1b |
Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
Synonyms |
3,7-Cyclodecadien-1-one, 3,7-dimethyl-10-(1-methylethylidene)-, (3E,7E)- |
Wiley ID |
LM_FFNSC3_1658 |