| SpectraBase Spectrum ID |
GSyCmql6ATW |
| Name |
Ethyl 3-cyano-4,5,6,7-tetrahydro-2-methylaminobenzo[b]thiophene-4-carboxylate |
| Alternate Name(s) |
ethyl 3-cyano-2-(methylamino)-4,5,6,7-tetrahydro-1-benzothiophene-4-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H16N2O2S |
| InChI |
InChI=1S/C13H16N2O2S/c1-3-17-13(16)8-5-4-6-10-11(8)9(7-14)12(15-2)18-10/h8,15H,3-6H2,1-2H3 |
| InChIKey |
NJTBGRYPIPPFPN-UHFFFAOYSA-N |
| Molecular Weight |
264.343 g/mol |
| SMILES |
N(c1c(c2c(CCCC2C(=O)OCC)s1)C#N)C |
| SPLASH |
splash10-0006-0940000000-9f9b7cf342779966749e |
| Source of Spectrum |
H1-50-1102-5 |
| Wiley ID |
816945 |
![Ethyl 3-cyano-4,5,6,7-tetrahydro-2-methylaminobenzo[b]thiophene-4-carboxylate](/api/spectrum/GSyCmql6ATW/structure.png?h=300&w=458 "Ethyl 3-cyano-4,5,6,7-tetrahydro-2-methylaminobenzo[b]thiophene-4-carboxylate")
