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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 K0VuYdJ91NG
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 COc1sc(cc1\C=C\N(=O)=O)SC
SPLASH splash10-0002-9300000000-a936d9365e4282fc7f59
Source of Spectrum AD-0-2532-0
Wiley ID 1424639