SpectraBase Spectrum ID |
eae3wyKZ5g |
Name |
Methyl (Z)-2-[1-hydroxy-1-(4-nitrophenyl)methyl]-3-methylsulfanyl acrylate |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H13NO5S |
InChI |
InChI=1S/C12H13NO5S/c1-18-12(15)10(7-19-2)11(14)8-3-5-9(6-4-8)13(16)17/h3-7,11,14H,1-2H3/b10-7- |
InChIKey |
MKYPRHZWFGHNFK-YFHOEESVSA-N |
Molecular Weight |
283.298 g/mol |
SMILES |
OC(\C(C(=O)OC)=C\SC)c1ccc(N(=O)=O)cc1 |
SPLASH |
splash10-000i-0090000000-cae6d3744999eff89204 |
Source of Spectrum |
QF-9-1501-9 |
Synonyms |
methyl (2Z)-2-[hydroxy(4-nitrophenyl)methyl]-3-(methylsulfanyl)-2-propenoate |
Wiley ID |
1558277 |