| SpectraBase Spectrum ID |
L38DULRodXn |
| Name |
Methyl 5-benzyl-4-oxo-1,2,3,4,5,6-hexahydro-azepino[4,5-b]indole-5-carboxylate |
| Alternate Name(s) |
4-oxo-5-(phenylmethyl)-1,2,3,6-tetrahydroazepino[4,5-b]indole-5-carboxylic acid methyl ester
methyl 5-benzyl-4-oxo-1,2,3,6-tetrahydroazepino[4,5-b]indole-5-carboxylate
methyl 4-oxidanylidene-5-(phenylmethyl)-1,2,3,6-tetrahydroazepino[4,5-b]indole-5-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H20N2O3 |
| InChI |
InChI=1S/C21H20N2O3/c1-26-20(25)21(13-14-7-3-2-4-8-14)18-16(11-12-22-19(21)24)15-9-5-6-10-17(15)23-18/h2-10,23H,11-13H2,1H3,(H,22,24) |
| InChIKey |
QCABYRCLEUTNFQ-UHFFFAOYSA-N |
| Molecular Weight |
348.402 g/mol |
| SMILES |
N1CCc2c(C(C1=O)(C(=O)OC)Cc1ccccc1)[nH]c1ccccc21 |
| SPLASH |
splash10-0a4j-0095000000-fe51fa7a3eae31f50414 |
| Source of Spectrum |
F5-7-1394-29 |
| Wiley ID |
1696411 |
![Methyl 5-benzyl-4-oxo-1,2,3,4,5,6-hexahydro-azepino[4,5-b]indole-5-carboxylate](/api/spectrum/L38DULRodXn/structure.png?h=300&w=458 "Methyl 5-benzyl-4-oxo-1,2,3,4,5,6-hexahydro-azepino[4,5-b]indole-5-carboxylate")
