SpectraBase Spectrum ID |
BlpZpCzy1Gl |
Name |
1-(4-Methoxyphenyl)-2-(methylthio)-1-phenylethylene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
256.092186308 u |
Formula |
C16H16OS |
InChI |
InChI=1S/C16H16OS/c1-17-15-10-8-14(9-11-15)16(12-18-2)13-6-4-3-5-7-13/h3-12H,1-2H3/b16-12- |
InChIKey |
YFQLGKNERVAJEG-VBKFSLOCSA-N |
Molecular Weight |
256.363 g/mol |
SMILES |
C1(\C(=C/SC)C=2C=CC=CC2)=CC=C(C=C1)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92298 |