| SpectraBase Spectrum ID |
3grfMLteVBP |
| Name |
(E)-3-(3-carbamoyl-1-methyl-2-indolyl)-2-propenoic acid methyl ester |
| Alternate Name(s) |
(E)-3-(3-carbamoyl-1-methyl-indol-2-yl)acrylic acid methyl ester
methyl (E)-3-(3-aminocarbonyl-1-methyl-indol-2-yl)prop-2-enoate
methyl (E)-3-(3-carbamoyl-1-methyl-indol-2-yl)prop-2-enoate |
| CAS Registry Number |
127744-56-3 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H14N2O3 |
| InChI |
InChI=1S/C14H14N2O3/c1-16-10-6-4-3-5-9(10)13(14(15)18)11(16)7-8-12(17)19-2/h3-8H,1-2H3,(H2,15,18)/b8-7+ |
| InChIKey |
DBRIJLOEBJAPBW-BQYQJAHWSA-N |
| Molecular Weight |
258.277 g/mol |
| SMILES |
NC(c1c([n](C)c2c1cccc2)\C=C\C(=O)OC)=O |
| SPLASH |
splash10-0002-0910000000-d9b2a5df4b500ab275b8 |
| Source of Spectrum |
F-45-6438-13 |
| Wiley ID |
1261652 |
