| SpectraBase Spectrum ID |
67Pdr7zdaKD |
| Name |
Benzoic acid, 4-butyl-, methyl ester |
| Alternate Name(s) |
Benzoic acid, p-butyl-, methyl ester
Methyl 4-butylbenzoate
4-Butylbenzoic acid methyl ester
Methyl p-butylbenzoate
EINECS 243-939-3 |
| CAS Registry Number |
20651-69-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H16O2 |
| InChI |
InChI=1S/C12H16O2/c1-3-4-5-10-6-8-11(9-7-10)12(13)14-2/h6-9H,3-5H2,1-2H3 |
| InChIKey |
XJRYQLPELPLPHZ-UHFFFAOYSA-N |
| Molecular Weight |
192.258 g/mol |
| SMILES |
c1cc(ccc1C(=O)OC)CCCC |
| SPLASH |
splash10-0gvn-0900000000-47cf76096ee53d726e9d |
| Source of Spectrum |
J-53-4488-0 |
| Wiley ID |
1188738 |
