SpectraBase Spectrum ID |
97Y7vgYCBwV |
Name |
2-Benzylidene-1-methylhydrazinecarbothioamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
193.067368540 u |
Formula |
C9H11N3S |
InChI |
InChI=1S/C9H11N3S/c1-12(9(10)13)11-7-8-5-3-2-4-6-8/h2-7H,1H3,(H2,10,13)/b11-7+ |
InChIKey |
CQRRYFDERNDLSA-YRNVUSSQSA-N |
Molecular Weight |
193.268 g/mol |
SMILES |
C=1(\C=N\N(C(N)=S)C)C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.946586 |