| SpectraBase Spectrum ID |
AH546KTnYfZ |
| Name |
Butyl 4-methylbenzoate |
| CAS Registry Number |
19277-56-6 |
| Classification |
Chemical |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
192.115029753 u |
| Formula |
C12H16O2 |
| InChI |
InChI=1S/C12H16O2/c1-3-4-9-14-12(13)11-7-5-10(2)6-8-11/h5-8H,3-4,9H2,1-2H3 |
| InChIKey |
UYGHRCCJWWYXMY-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
192.258 g/mol |
| Nominal Mass |
192 u |
| Quality |
955 |
| Retention Index |
1510 |
| SMILES |
C=1(C(OCCCC)=O)C=CC(=CC1)C |
| SPLASH |
splash10-014r-7900000000-7ee0dfabb76bfe1ba5ac |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
p-Toluic acid buyl ester |
| Technique |
GC/MS |
| Wiley ID |
DD2024_004331 |
