| SpectraBase Spectrum ID |
JFWQBpjyO5Q |
| Name |
Hexyl 2-methoxy benzoate |
| CAS Registry Number |
71605-88-4 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
236.141244501 u |
| Formula |
C14H20O3 |
| InChI |
InChI=1S/C14H20O3/c1-3-4-5-8-11-17-14(15)12-9-6-7-10-13(12)16-2/h6-7,9-10H,3-5,8,11H2,1-2H3 |
| InChIKey |
UMXZQFHEWNEFNM-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
236.311 g/mol |
| Nominal Mass |
236 u |
| Quality |
979 |
| Retention Index |
1783 |
| SMILES |
C=1(C(=CC=CC1)OC)C(OCCCCCC)=O |
| SPLASH |
splash10-000i-2900000000-5ed83087797c1716450d |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Hexyl o-anisate
2-Methoxy-benzoic acid hexyl ester
o-Methoxybenzoic acid hexyl ester
Hexyl-2-methoxy benzoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_015037 |
