| SpectraBase Spectrum ID |
1cbYfJwbBbD |
| Name |
OCTANOIC ACID, PENTYL ESTER |
| 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 |
214.193280075 u |
| Formula |
C13H26O2 |
| InChI |
InChI=1S/C13H26O2/c1-3-5-7-8-9-11-13(14)15-12-10-6-4-2/h3-12H2,1-2H3 |
| InChIKey |
GJWGZSBNFSBUPX-UHFFFAOYSA-N |
| Molecular Weight |
214.349 g/mol |
| Nominal Mass |
214 u |
| Number of Peaks |
83 |
| SMILES |
C(CCCCC(OCCCCC)=O)CC |
| SPLASH |
splash10-0596-9100000000-8717d628277f85e3fd00 |
| Source of Spectrum |
Chemical Concepts, A Wiley Division, Weinheim, Germany |
| Wiley ID |
MVX001422 |
