| SpectraBase Spectrum ID |
KUSDCqGJULq |
| Name |
2-hydroxy-2-(1-methyl-3-indolyl)propanedioic acid diethyl ester |
| Alternate Name(s) |
Propanedioic acid, hydroxy(1-methyl-1H-indol-3-yl)-, diethyl ester
2-hydroxy-2-(1-methylindol-3-yl)malonic acid diethyl ester
diethyl 2-(1-methylindol-3-yl)-2-oxidanyl-propanedioate
diethyl 2-hydroxy-2-(1-methylindol-3-yl)propanedioate |
| CAS Registry Number |
127744-44-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H19NO5 |
| InChI |
InChI=1S/C16H19NO5/c1-4-21-14(18)16(20,15(19)22-5-2)12-10-17(3)13-9-7-6-8-11(12)13/h6-10,20H,4-5H2,1-3H3 |
| InChIKey |
WCBCPSKZHGTDRH-UHFFFAOYSA-N |
| Molecular Weight |
305.330 g/mol |
| SMILES |
OC(c1c[n](C)c2c1cccc2)(C(=O)OCC)C(=O)OCC |
| SPLASH |
splash10-0a4i-0901000000-9998e573261876bc5153 |
| Source of Spectrum |
F-45-6433-1 |
| Wiley ID |
1307272 |
