| SpectraBase Spectrum ID |
63kLqMyDLck |
| Name |
3,5A,6,11B-Tetrahydro-2H,5H-chromeno[4',3':4,5]thiopyrano[2,3-D][1,3]thiazol-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
277.023120944 u |
| Formula |
C13H11NO2S2 |
| InChI |
InChI=1S/C13H11NO2S2/c15-13-14-12-11(18-13)10-7(6-17-12)5-16-9-4-2-1-3-8(9)10/h1-4,7,10H,5-6H2,(H,14,15) |
| InChIKey |
ALZXUICHTVTLKW-UHFFFAOYSA-N |
| SMILES |
C12=C(NC(S2)=O)SCC2C1C1=C(C=CC=C1)OC2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.961414 |
![3,5a,6,11b-tetrahydro-2H,5H-chromeno[4',3':4,5]thiopyrano[2,3-d][1,3]thiazol-2-one](/api/spectrum/63kLqMyDLck/structure.png?h=300&w=458 "3,5a,6,11b-tetrahydro-2H,5H-chromeno[4',3':4,5]thiopyrano[2,3-d][1,3]thiazol-2-one")
