| SpectraBase Spectrum ID |
CGBQlRZzTqp |
| Name |
cis-(Z)-(3-Methyltetrahydrofuro[2,3-D]thiazolo-2(3H)-ylidene)-1-phenylethanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
261.082349899 u |
| Formula |
C14H15NO2S |
| InChI |
InChI=1S/C14H15NO2S/c1-15-13(18-12-7-8-17-14(12)15)9-11(16)10-5-3-2-4-6-10/h2-6,9,12,14H,7-8H2,1H3/b13-9-/t12-,14+/m0/s1 |
| InChIKey |
GRLRLGLMCIJHRK-OIZKETEYSA-N |
| Molecular Weight |
261.339 g/mol |
| SMILES |
[C@@]12(N(\C(S[C@]1(CCO2)[H])=C\C(=O)C=1C=CC=CC1)C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.871981 |
![cis-(Z)-(3-Methyltetrahydrofuro[2,3-d]thiazolo-2(3H)-ylidene)-1-phenylethanone](/api/spectrum/CGBQlRZzTqp/structure.png?h=300&w=458 "cis-(Z)-(3-Methyltetrahydrofuro[2,3-d]thiazolo-2(3H)-ylidene)-1-phenylethanone")
