| SpectraBase Spectrum ID |
A65mj8Thx24 |
| Name |
2,3-Dihydro-2(S),5-dimethyl-1,5-benzoxazepin-4(5H)-thione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
207.071785216 u |
| Formula |
C11H13NOS |
| InChI |
InChI=1S/C11H13NOS/c1-8-7-11(14)12(2)9-5-3-4-6-10(9)13-8/h3-6,8H,7H2,1-2H3/t8-/m0/s1 |
| InChIKey |
UJAYRMCBJWNNOX-QMMMGPOBSA-N |
| Molecular Weight |
207.291 g/mol |
| SMILES |
C1(N(C=2C(O[C@](C1)(C)[H])=CC=CC2)C)=S |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932754 |
