| SpectraBase Spectrum ID |
9BiDBhOr5jx |
| Name |
Benzoic acid, 2,4,6-trimethyl-, methyl ester |
| Alternate Name(s) |
2,4,6-(CH3)3-C6H2-COOCH3
2,4,6-trimethylbenzoic acid methyl ester
Methyl .beta.-isodurilate
Methyl 2,4,6-trimethylbenzoate
Methyl mesitoate |
| CAS Registry Number |
2282-84-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H14O2 |
| InChI |
InChI=1S/C11H14O2/c1-7-5-8(2)10(9(3)6-7)11(12)13-4/h5-6H,1-4H3 |
| InChIKey |
PXLABDTXHJPRRH-UHFFFAOYSA-N |
| Molecular Weight |
178.231 g/mol |
| SMILES |
Cc1cc(c(c(c1)C)C(=O)OC)C |
| SPLASH |
splash10-00kb-4900000000-94b4aedc5f7bc3ada132 |
| Source of Spectrum |
W5-11906-0-0 |
| Wiley ID |
1174100 |
