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Methyl 2-[1-benzyl-5-(methylsulfanyl)-4-nitro-2-oxo-1,2-dihydro-3H-pyrrol-3-yliden]acetate
SpectraBase Compound ID 3HWO6l8781o
InChI InChI=1S/C15H14N2O5S/c1-22-12(18)8-11-13(17(20)21)15(23-2)16(14(11)19)9-10-6-4-3-5-7-10/h3-8H,9H2,1-2H3/b11-8-
InChIKey HJRACGNXJZWHBP-FLIBITNWSA-N
Mol Weight 334.35 g/mol
Molecular Formula C15H14N2O5S
Exact Mass 334.062343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GSSek0x8tx5
Name Methyl 2-[1-benzyl-5-(methylsulfanyl)-4-nitro-2-oxo-1,2-dihydro-3H-pyrrol-3-yliden]acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14N2O5S
InChI InChI=1S/C15H14N2O5S/c1-22-12(18)8-11-13(17(20)21)15(23-2)16(14(11)19)9-10-6-4-3-5-7-10/h3-8H,9H2,1-2H3/b11-8-
InChIKey HJRACGNXJZWHBP-FLIBITNWSA-N
Molecular Weight 334.346 g/mol
SMILES C=1(\C(C(=O)N(C1SC)Cc1ccccc1)=C\C(=O)OC)N(=O)=O
SPLASH splash10-0006-9112000000-370a10479321cb109e67
Source of Spectrum Y-51-531-3j
Synonyms (Z)-methyl 2-(1-benzyl-5-(methylthio)-4-nitro-2-oxo-1H-pyrrol-3(2H)-ylidene)acetate
Wiley ID 1741284