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(Z)-Methyl 3-(2-azido-5-nitrophenyl)-5-(p-tolylsulfinylmethyl)-propenoate
SpectraBase Compound ID EOmld0JlgOQ
InChI InChI=1S/C18H16N4O5S/c1-12-3-6-16(7-4-12)28(26)11-14(18(23)27-2)9-13-10-15(22(24)25)5-8-17(13)20-21-19/h3-10H,11H2,1-2H3/b14-9-
InChIKey MKWKWBPQBUMIML-ZROIWOOFSA-N
Mol Weight 400.41 g/mol
Molecular Formula C18H16N4O5S
Exact Mass 400.084141 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4qnxogYgJIX
Name (Z)-Methyl 3-(2-azido-5-nitrophenyl)-5-(p-tolylsulfinylmethyl)-propenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16N4O5S
InChI InChI=1S/C18H16N4O5S/c1-12-3-6-16(7-4-12)28(26)11-14(18(23)27-2)9-13-10-15(22(24)25)5-8-17(13)20-21-19/h3-10H,11H2,1-2H3/b14-9-
InChIKey MKWKWBPQBUMIML-ZROIWOOFSA-N
Molecular Weight 400.409 g/mol
SMILES c1(\C=C/(C(=O)OC)CS(c2ccc(C)cc2)=O)cc(N(=O)=O)ccc1N=[N+]=[N-]
SPLASH splash10-0un9-0690000000-597d0427c182be9d8ef0
Source of Spectrum F-65-9621-7k
Wiley ID 1678804