| SpectraBase Spectrum ID |
4oZQWm4jeka |
| Name |
Hexanoate |
| Source of Sample |
SAFC Cat.no. W354503 |
| CAS Registry Number |
2305-25-1 |
| 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 |
160.109944372 u |
| Formula |
C8H16O3 |
| InChI |
InChI=1S/C8H16O3/c1-3-5-7(9)6-8(10)11-4-2/h7,9H,3-6H2,1-2H3 |
| InChIKey |
LYRIITRHDCNUHV-UHFFFAOYSA-N |
| Molecular Weight |
160.213 g/mol |
| Number of Peaks |
50 |
| RI1 |
1129 |
| RI2 |
806 |
| RI3 |
1082 |
| RI4 |
1038 |
| SMILES |
OC(CC(OCC)=O)CCC |
| SPLASH |
splash10-00y3-9100000000-7bc63f6a0c1145c877d1 |
| 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, 3-hydroxy-, ethyl ester |
| Wiley ID |
LM_FFNSC3_356 |
