| SpectraBase Spectrum ID |
5j5dL7zPETT |
| Name |
3-(1-hydroxy-1-methyl-ethyl)coumaran-5-carboxylic acid ethyl ester |
| Alternate Name(s) |
3-(2-hydroxypropan-2-yl)-2,3-dihydrobenzofuran-5-carboxylic acid ethyl ester
ethyl 3-(1-hydroxy-1-methyl-ethyl)-2,3-dihydrobenzofuran-5-carboxylate
ethyl 3-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-5-carboxylate
ethyl 3-(2-oxidanylpropan-2-yl)-2,3-dihydro-1-benzofuran-5-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H18O4 |
| InChI |
InChI=1S/C14H18O4/c1-4-17-13(15)9-5-6-12-10(7-9)11(8-18-12)14(2,3)16/h5-7,11,16H,4,8H2,1-3H3 |
| InChIKey |
WODHKSOWOGHFJV-UHFFFAOYSA-N |
| Molecular Weight |
250.294 g/mol |
| SMILES |
OC(C1c2cc(C(=O)OCC)ccc2OC1)(C)C |
| SPLASH |
splash10-0006-0900000000-6bd0dfdb3a621d17891b |
| Source of Spectrum |
J-58-2491-0 |
| Wiley ID |
1253382 |
