| SpectraBase Spectrum ID |
70QZ5kBFdBj |
| Name |
Diethyl 2-hydroxy-2-(4-ethoxycarbonyl-1-methyl-1H-indol-3-ylmethyl)propanedioate |
| Alternate Name(s) |
diethyl 2-{1-[4-(ethoxycarbonyl)-1H-indol-3-yl]ethyl}-2-hydroxymalonate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H25NO7 |
| InChI |
InChI=1S/C20H25NO7/c1-5-26-17(22)13-9-8-10-15-16(13)14(11-21-15)12(4)20(25,18(23)27-6-2)19(24)28-7-3/h8-12,21,25H,5-7H2,1-4H3 |
| InChIKey |
DTXFPSBLODUOFZ-UHFFFAOYSA-N |
| Molecular Weight |
391.420 g/mol |
| SMILES |
OC(C(c1c[nH]c2cccc(c12)C(=O)OCC)C)(C(=O)OCC)C(=O)OCC |
| SPLASH |
splash10-014i-0090000000-76171499d9f5b1c69fb9 |
| Source of Spectrum |
QE-8-2043-10 |
| Wiley ID |
1557632 |
