| SpectraBase Spectrum ID |
12EhuHEtnMp |
| Name |
Acetic acid, octyl ester |
| CAS Registry Number |
112-14-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H20O2 |
| InChI |
InChI=1S/C10H20O2/c1-3-4-5-6-7-8-9-12-10(2)11/h3-9H2,1-2H3 |
| InChIKey |
YLYBTZIQSIBWLI-UHFFFAOYSA-N |
| Molecular Weight |
172.268 g/mol |
| SMILES |
C(=O)(OCCCCCCCC)C |
| SPLASH |
splash10-0a4i-9000000000-d72fc63c696913dbb5cf |
| Source of Spectrum |
F4-40-3629-4g |
| Synonyms |
1-Octanol acetate
1-Octyl acetate
Octyl alcohol acetate
Acetate C-8
acetic acid octyl ester
Acetic acid n-octyl ester
Caprylyl acetate
n-Octanyl acetate
n-Octyl acetate
Octyl acetate
n-Octyl ethanoate
Octyl acetate, normal
octyl ethanoate
AI3-11269
BRN 1754554
EINECS 203-939-6
FEMA NO. 2806
NSC 67348 |
| Wiley ID |
1671258 |
