| SpectraBase Spectrum ID |
EHIICOqYpq1 |
| Name |
2-Phenylcarbonylimino-3,4,4-trimethyl-5-methylene-thiazoline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
260.098334316 u |
| Formula |
C14H16N2OS |
| InChI |
InChI=1S/C14H16N2OS/c1-10-14(2,3)16(4)13(18-10)15-12(17)11-8-6-5-7-9-11/h5-9H,1H2,2-4H3/b15-13+ |
| InChIKey |
QVEJFUOWECKEBW-FYWRMAATSA-N |
| Molecular Weight |
260.355 g/mol |
| SMILES |
C(\N=C/1N(C(C)(C)C(S1)=C)C)(=O)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.958262 |
