| SpectraBase Spectrum ID |
Ayg0xoJFs8g |
| Name |
Hexanoate |
| Source of Sample |
SAFC Cat.no. W257206 |
| CAS Registry Number |
6378-65-0 |
| 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 |
200.177630011 u |
| Formula |
C12H24O2 |
| InChI |
InChI=1S/C12H24O2/c1-3-5-7-9-11-14-12(13)10-8-6-4-2/h3-11H2,1-2H3 |
| InChIKey |
NCDCLPBOMHPFCV-UHFFFAOYSA-N |
| Molecular Weight |
200.322 g/mol |
| Number of Peaks |
50 |
| RI1 |
1390 |
| RI2 |
1069 |
| RI3 |
1014 |
| RI4 |
972 |
| SMILES |
CCCCCCOC(CCCCC)=O |
| SPLASH |
splash10-00kf-9100000000-180caa072ead959e43f2 |
| 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 |
Hexanoic acid, hexyl ester |
| Wiley ID |
LM_FFNSC3_434 |
