| SpectraBase Spectrum ID |
3Kqxp2fozIj |
| Name |
Octanoic acid |
| Source of Sample |
SAFC Cat. #W279900 |
| CAS Registry Number |
124-07-2 |
| Classification |
Pesticides: Bactericides |
| Comments |
Generally Recognized as Safe; NTIS Accession Number: PB254530 |
| 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 |
144.115029753 u |
| Formula |
C8H16O2 |
| InChI |
InChI=1S/C8H16O2/c1-2-3-4-5-6-7-8(9)10/h2-7H2,1H3,(H,9,10) |
| InChIKey |
WWZKQHOCKIZLMA-UHFFFAOYSA-N |
| Molecular Weight |
144.214 g/mol |
| Number of Peaks |
39 |
| RI1 |
1192 |
| RI2 |
1196 |
| SMILES |
OC(CCCCCCC)=O |
| SPLASH |
splash10-01vo-9000000000-6764f49fb32206ac5026 |
| Sample Comments |
RI1: measured on SLB-5ms (Alkanes)
RI2: measured on Equity-1 (Alkanes) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
Octanoic acid |
| Wiley ID |
LM_PEST_1163 |
