| SpectraBase Spectrum ID |
91VI1zFPvS0 |
| Name |
2-(2-Hydroxy-4-methoxybenzoyl)-4-methyl-4-cyclohexenecarboxylic acid |
| CAS Registry Number |
78149-74-3 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H18O5 |
| InChI |
InChI=1S/C16H18O5/c1-9-3-5-11(16(19)20)13(7-9)15(18)12-6-4-10(21-2)8-14(12)17/h3-4,6,8,11,13,17H,5,7H2,1-2H3,(H,19,20) |
| InChIKey |
MLLRXXIMHJZZSU-UHFFFAOYSA-N |
| Molecular Weight |
290.315 g/mol |
| SMILES |
OC(C1C(C(c2c(cc(cc2)OC)O)=O)CC(=CC1)C)=O |
| SPLASH |
splash10-0udi-0930000000-427a28dea6c81631221f |
| Source of Spectrum |
J-46-3916-0 |
| Synonyms |
6-(2-hydroxy-4-methoxybenzoyl)-4-methyl-3-cyclohexene-1-carboxylic acid |
| Wiley ID |
1293559 |
