| SpectraBase Spectrum ID |
zI8gQ7AbEI |
| Name |
1-Methylbutyl octanoate |
| CAS Registry Number |
55193-30-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H26O2 |
| InChI |
InChI=1S/C13H26O2/c1-4-6-7-8-9-11-13(14)15-12(3)10-5-2/h12H,4-11H2,1-3H3 |
| InChIKey |
ZZILRVYYTFVLGI-UHFFFAOYSA-N |
| Molecular Weight |
214.349 g/mol |
| SMILES |
CCCCCCCC(OC(CCC)C)=O |
| SPLASH |
splash10-05dl-9600000000-c39ac2f3873bd4d93978 |
| Source of Spectrum |
NP-4-9579-0 |
| Synonyms |
Octanoic acid, 2-pentyl ester
Octanoic acid pentan-2-yl ester
Pentan-2-yl octanoate |
| Wiley ID |
1104435 |
