| SpectraBase Spectrum ID |
EvXt2cCwG7N |
| Name |
OCTANOIC ACID, 3-METHYLBUTYL 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/c1-4-5-6-7-8-9-13(14)15-11-10-12(2)3/h12H,4-11H2,1-3H3 |
| InChIKey |
XKWSWANXMRXDES-UHFFFAOYSA-N |
| Molecular Weight |
214.349 g/mol |
| Nominal Mass |
214 u |
| Number of Peaks |
57 |
| SMILES |
C(CC)CCCCC(OCCC(C)C)=O |
| SPLASH |
splash10-05i3-9100000000-7bf094f6862503dc73ce |
| Source of Spectrum |
Chemical Concepts, A Wiley Division, Weinheim, Germany |
| Wiley ID |
MVX000182 |
