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O-(Methylthio)aniline
SpectraBase Compound ID BR7NX2Boihc
InChI InChI=1S/C7H9NS/c1-9-7-5-3-2-4-6(7)8/h2-5H,8H2,1H3
InChIKey WBRPQQSADOCKCH-UHFFFAOYSA-N
Mol Weight 139.22 g/mol
Molecular Formula C7H9NS
Exact Mass 139.04557 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHKt0N5fg0g
Name 2-(Methylthio)aniline
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9NS
InChI InChI=1S/C7H9NS/c1-9-7-5-3-2-4-6(7)8/h2-5H,8H2,1H3
InChIKey WBRPQQSADOCKCH-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1002/ajoc.202100063
Molecular Weight 139.216 g/mol
SMILES Nc1c(cccc1)SC
SPLASH splash10-0079-2900000000-36ecd976f2805c9c0dd1
Source of Spectrum AJO-10-SM18-2i
Wiley ID 1866294