| SpectraBase Spectrum ID |
3bhMcA6lSFt |
| Name |
Methyl pentanoate <2-hydroxy-3-methyl-> |
| CAS Registry Number |
41654-19-7 |
| 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 |
146.094294308 u |
| Formula |
C7H14O3 |
| InChI |
InChI=1S/C7H14O3/c1-4-5(2)6(8)7(9)10-3/h5-6,8H,4H2,1-3H3 |
| InChIKey |
OQXGUAUSWWFHOM-UHFFFAOYSA-N |
| Molecular Weight |
146.186 g/mol |
| Number of Peaks |
44 |
| RI1 |
991 |
| SMILES |
OC(C(CC)C)C(=O)OC |
| SPLASH |
splash10-0007-9000000000-db0b7b76a96c7457eef5 |
| 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 |
Pentanoic acid, 2-hydroxy-3-methyl-, methyl ester |
| Wiley ID |
LM_FFNSC3_2893 |
