| SpectraBase Spectrum ID |
9uf8KdYLhB7 |
| Name |
2-hydroxy-2-[2-[(E)-3-keto-3-methoxy-prop-1-enyl]-1-methyl-indol-3-yl]malonic acid diethyl ester |
| Alternate Name(s) |
2-hydroxy-2-[2-[(E)-3-methoxy-3-oxoprop-1-enyl]-1-methyl-3-indolyl]propanedioic acid diethyl ester
diethyl 2-hydroxy-2-[2-[(E)-3-methoxy-3-oxo-prop-1-enyl]-1-methyl-indol-3-yl]propanedioate
diethyl 2-[2-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]-1-methyl-indol-3-yl]-2-oxidanyl-propanedioate |
| CAS Registry Number |
133823-13-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H23NO7 |
| InChI |
InChI=1S/C20H23NO7/c1-5-27-18(23)20(25,19(24)28-6-2)17-13-9-7-8-10-14(13)21(3)15(17)11-12-16(22)26-4/h7-12,25H,5-6H2,1-4H3/b12-11+ |
| InChIKey |
HLDLHWLVZVKVFW-VAWYXSNFSA-N |
| Molecular Weight |
389.404 g/mol |
| SMILES |
OC(c1c([n](C)c2c1cccc2)\C=C\C(=O)OC)(C(=O)OCC)C(=O)OCC |
| SPLASH |
splash10-0006-0091000000-fdb6f0869268df27e6ec |
| Source of Spectrum |
F-45-6435-6 |
| Wiley ID |
1364316 |
![2-hydroxy-2-[2-[(E)-3-keto-3-methoxy-prop-1-enyl]-1-methyl-indol-3-yl]malonic acid diethyl ester](/api/spectrum/9uf8KdYLhB7/structure.png?h=300&w=458 "2-hydroxy-2-[2-[(E)-3-keto-3-methoxy-prop-1-enyl]-1-methyl-indol-3-yl]malonic acid diethyl ester")
