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N1-methyl-4-thiocyanatobenzene-1,2-diamine
SpectraBase Compound ID HI4YO1Q5rpJ
InChI InChI=1S/C8H9N3S/c1-11-8-3-2-6(12-5-9)4-7(8)10/h2-4,11H,10H2,1H3
InChIKey LFEWMSMLKBHQSN-UHFFFAOYSA-N
Mol Weight 179.24 g/mol
Molecular Formula C8H9N3S
Exact Mass 179.051718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LQad7iPERPf
Name N1-methyl-4-thiocyanatobenzene-1,2-diamine
Alternate Name(s) [3-amino-4-(methylamino)phenyl] thiocyanate [3-azanyl-4-(methylamino)phenyl] thiocyanate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H9N3S
InChI InChI=1S/C8H9N3S/c1-11-8-3-2-6(12-5-9)4-7(8)10/h2-4,11H,10H2,1H3
InChIKey LFEWMSMLKBHQSN-UHFFFAOYSA-N
Molecular Weight 179.241 g/mol
SMILES N(C)c1c(cc(cc1)SC#N)N
SPLASH splash10-004i-2900000000-03b5bff3b77b81bd6620
Source of Spectrum JX-2012-797
Wiley ID 1661243