SpectraBase Spectrum ID |
D0B8VXfhTiK |
Name |
Citronellyl valerate |
Source of Sample |
SAFC Cat.no. W231703 |
CAS Registry Number |
7540-53-6 |
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 |
240.208930140 u |
Formula |
C15H28O2 |
InChI |
InChI=1S/C15H28O2/c1-5-6-10-15(16)17-12-11-14(4)9-7-8-13(2)3/h8,14H,5-7,9-12H2,1-4H3 |
InChIKey |
PFOJEJPZUVQHEH-UHFFFAOYSA-N |
Molecular Weight |
240.387 g/mol |
Number of Peaks |
50 |
RI1 |
1624 |
RI2 |
1302 |
RI3 |
1294 |
RI4 |
1252 |
RI5 |
1608 |
SMILES |
C(CCCC)(=O)OCCC(C)CCC=C(C)C |
SPLASH |
splash10-05o1-9100000000-26aea07816453c2e2e4d |
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 |
Pentanoic acid, 3,7-dimethyl-6-octenyl ester |
Wiley ID |
LM_FFNSC3_59 |