| SpectraBase Spectrum ID |
DgZNXD2GN6P |
| Name |
Benzeneacetic acid, 3-hydroxy-4-methoxy-2,6-dimethyl-, ethyl ester |
| Alternate Name(s) |
ethyl (3-hydroxy-4-methoxy-2,6-dimethylphenyl)acetate
Ethyl ester of 2,6-dimethyl-3-hydroxy-4-methoxyphenylacetic acid |
| CAS Registry Number |
80367-36-8 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H18O4 |
| InChI |
InChI=1S/C13H18O4/c1-5-17-12(14)7-10-8(2)6-11(16-4)13(15)9(10)3/h6,15H,5,7H2,1-4H3 |
| InChIKey |
HMFJAWDEZAKQJF-UHFFFAOYSA-N |
| Molecular Weight |
238.283 g/mol |
| SMILES |
Oc1c(c(c(cc1OC)C)CC(=O)OCC)C |
| SPLASH |
splash10-014i-0920000000-b60f14b7f4193c90475e |
| Source of Spectrum |
J-47-613-0 |
| Wiley ID |
1240461 |
