| SpectraBase Spectrum ID |
6fYSxRjjWK |
| Name |
(nz)-N-[3-[(E)-but-2-Enyl]-1,3-benzothiazol-2-ylidene]nitrous amide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
233.062283159 u |
| Formula |
C11H11N3OS |
| InChI |
InChI=1S/C11H11N3OS/c1-2-3-8-14-9-6-4-5-7-10(9)16-11(14)12-13-15/h2-7H,8H2,1H3/b3-2+,12-11- |
| InChIKey |
VHHYNBMJJTXISY-MXOBTGDISA-N |
| Molecular Weight |
233.289 g/mol |
| SMILES |
C=12N(\C(SC1C=CC=C2)=N\N=O)C\C=C\C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.912716 |
![(nz)-N-[3-[(E)-but-2-Enyl]-1,3-benzothiazol-2-ylidene]nitrous amide](/api/spectrum/6fYSxRjjWK/structure.png?h=300&w=458 "(nz)-N-[3-[(E)-but-2-Enyl]-1,3-benzothiazol-2-ylidene]nitrous amide")
