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Ethyl (Z)-3-phenyl-2-(thiocyanatomethyl)acrylate
SpectraBase Compound ID CPUT4iO9H1L
InChI InChI=1S/C13H13NO2S/c1-2-16-13(15)12(9-17-10-14)8-11-6-4-3-5-7-11/h3-8H,2,9H2,1H3/b12-8+
InChIKey PEZBFNIARKHYJD-XYOKQWHBSA-N
Mol Weight 247.31 g/mol
Molecular Formula C13H13NO2S
Exact Mass 247.0667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IN1gadh1grQ
Name Ethyl (Z)-3-phenyl-2-(thiocyanatomethyl)acrylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13NO2S
InChI InChI=1S/C13H13NO2S/c1-2-16-13(15)12(9-17-10-14)8-11-6-4-3-5-7-11/h3-8H,2,9H2,1H3/b12-8+
InChIKey PEZBFNIARKHYJD-XYOKQWHBSA-N
Molecular Weight 247.312 g/mol
SMILES C(\C(=C\c1ccccc1)CSC#N)(=O)OCC
SPLASH splash10-014u-5900000000-f0facf32a696c34fcf2f
Source of Spectrum F4-0-2774-2
Synonyms Ethyl (2Z)-2-[(cyanosulfanyl)methyl]-3-phenyl-2-propenoate
Wiley ID 1620337