| SpectraBase Spectrum ID |
I4F1wW2EVmk |
| Name |
Benzoic acid, octyl ester |
| CAS Registry Number |
94-50-8 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H22O2 |
| InChI |
InChI=1S/C15H22O2/c1-2-3-4-5-6-10-13-17-15(16)14-11-8-7-9-12-14/h7-9,11-12H,2-6,10,13H2,1H3 |
| InChIKey |
VECVSKFWRQYTAL-UHFFFAOYSA-N |
| Molecular Weight |
234.339 g/mol |
| SMILES |
C(=O)(c1ccccc1)OCCCCCCCC |
| SPLASH |
splash10-00di-0900000000-6f613f95104d5e761e59 |
| Source of Spectrum |
F4-40-3629-4h |
| Synonyms |
Octyl Benzoate
n-Octyl benzoate
AI3-30501
EINECS 202-339-1
NSC 21846 |
| Wiley ID |
1671257 |
