| SpectraBase Spectrum ID |
K8mMsPDA3fg |
| Name |
3-(p-Bromophenyl)-2-[(4'-methylbenzoyl)imino]-4-methyl-1,3-thiazoline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
386.008847284 u |
| Formula |
C18H15BrN2OS |
| InChI |
InChI=1S/C18H15BrN2OS/c1-12-3-5-14(6-4-12)17(22)20-18-21(13(2)11-23-18)16-9-7-15(19)8-10-16/h3-11H,1-2H3/b20-18- |
| InChIKey |
BXCTUUNJVVHXQM-ZZEZOPTASA-N |
| Molecular Weight |
387.295 g/mol |
| SMILES |
C(\N=C\1N(C(C)=CS1)C=1C=CC(=CC1)Br)(C=1C=CC(=CC1)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.912356 |