SpectraBase Spectrum ID |
G39FvkmMwo9 |
Name |
Propanoate |
Source of Sample |
SAFC Cat.no. W235407 |
CAS Registry Number |
6222-35-1 |
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 |
156.115029753 u |
Formula |
C9H16O2 |
InChI |
InChI=1S/C9H16O2/c1-2-9(10)11-8-6-4-3-5-7-8/h8H,2-7H2,1H3 |
InChIKey |
MAMMVUWCKMOLSG-UHFFFAOYSA-N |
Molecular Weight |
156.225 g/mol |
Number of Peaks |
50 |
RI1 |
1135 |
RI2 |
813 |
RI3 |
763 |
RI4 |
715 |
RI5 |
1117 |
SMILES |
C(CC)(=O)OC1CCCCC1 |
SPLASH |
splash10-0a59-9000000000-dff3217658525f32b549 |
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 |
Propanoic acid, cyclohexyl ester |
Wiley ID |
LM_FFNSC3_42 |