| SpectraBase Spectrum ID |
DOlwE6Hv4An |
| Name |
Butyrate |
| Source of Sample |
SAFC Cat.no. W280704 |
| CAS Registry Number |
110-39-4 |
| 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/c1-3-5-6-7-8-9-11-14-12(13)10-4-2/h3-11H2,1-2H3 |
| InChIKey |
PWLNAUNEAKQYLH-UHFFFAOYSA-N |
| Molecular Weight |
200.322 g/mol |
| Number of Peaks |
50 |
| RI1 |
1391 |
| RI2 |
1070 |
| SMILES |
C(CCC)CCCCOC(CCC)=O |
| SPLASH |
splash10-05gu-9000000000-220ad063b524ced9033e |
| 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 |
Butanoic acid, octyl ester |
| Wiley ID |
LM_FFNSC3_910 |
