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Thiocyanic acid, o-anilinophenyl ester
SpectraBase Compound ID 2NQ8SP3BgOs
InChI InChI=1S/C13H10N2S/c14-10-16-13-9-5-4-8-12(13)15-11-6-2-1-3-7-11/h1-9,15H
InChIKey CMJVGJCIBWJCTK-UHFFFAOYSA-N
Mol Weight 226.3 g/mol
Molecular Formula C13H10N2S
Exact Mass 226.05647 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7tRDTQHPfhz
Name Thiocyanic acid, o-anilinophenyl ester
Alternate Name(s) 2-Anilinophenyl thiocyanate (2-phenylazanylphenyl) thiocyanate 2-Thiocyanatodiphenylamine Thiocyanic acid (2-anilinophenyl) ester N-phenyl-2-thiocyanatoaniline (2-anilinophenyl) thiocyanate
CAS Registry Number 15973-81-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10N2S
InChI InChI=1S/C13H10N2S/c14-10-16-13-9-5-4-8-12(13)15-11-6-2-1-3-7-11/h1-9,15H
InChIKey CMJVGJCIBWJCTK-UHFFFAOYSA-N
Molecular Weight 226.297 g/mol
SMILES N(c1c(cccc1)SC#N)c1ccccc1
SPLASH splash10-004i-2290000000-b86ec9e96992d74dfdb4
Source of Spectrum JX-2015-6-11669
Wiley ID 1731043