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2-Methoxy-5-(methylthio)-3-[(E)-2-nitroethenyl]thiophene
SpectraBase Compound ID CJ5ilnpv6TE
InChI InChI=1S/C8H9NO3S2/c1-12-8-6(3-4-9(10)11)5-7(13-2)14-8/h3-5H,1-2H3/b4-3+
InChIKey IIADIKIEAVYDBQ-ONEGZZNKSA-N
Mol Weight 231.28 g/mol
Molecular Formula C8H9NO3S2
Exact Mass 231.002385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EwbrKlimCNw
Name 2-Methoxy-5-(methylthio)-3-[(E)-2-nitroethenyl]thiophene
Alternate Name(s) 2-Methoxy-5-(methylthio)-3-[(E)-2-nitrovinyl]thiophene 2-Methoxy-5-methylsulfanyl-3-[(E)-2-nitrovinyl]thiophene
CAS Registry Number 95412-00-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H9NO3S2
InChI InChI=1S/C8H9NO3S2/c1-12-8-6(3-4-9(10)11)5-7(13-2)14-8/h3-5H,1-2H3/b4-3+
InChIKey IIADIKIEAVYDBQ-ONEGZZNKSA-N
Molecular Weight 231.284 g/mol
SMILES c1(sc(cc1\C=C\N(=O)=O)SC)OC
SPLASH splash10-001r-0890000000-0cf6acdb14de20120337
Source of Spectrum HC-20-963-0
Wiley ID 1232476