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(1-benzyl-2-oxo-3H-indol-5-yl) thiocyanate
SpectraBase Compound ID MukCMJoQLW
InChI InChI=1S/C16H12N2OS/c17-11-20-14-6-7-15-13(8-14)9-16(19)18(15)10-12-4-2-1-3-5-12/h1-8H,9-10H2
InChIKey BBZDQCZJUSHRTI-UHFFFAOYSA-N
Mol Weight 280.35 g/mol
Molecular Formula C16H12N2OS
Exact Mass 280.067034 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 69LjOY19DRZ
Name (1-benzyl-2-oxo-3H-indol-5-yl) thiocyanate
Alternate Name(s) (1-benzyl-2-oxo-indolin-5-yl) thiocyanate thiocyanic acid (1-benzyl-2-keto-indolin-5-yl) ester thiocyanic acid [2-oxo-1-(phenylmethyl)-3H-indol-5-yl] ester
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Formula C16H12N2OS
InChI InChI=1S/C16H12N2OS/c17-11-20-14-6-7-15-13(8-14)9-16(19)18(15)10-12-4-2-1-3-5-12/h1-8H,9-10H2
InChIKey BBZDQCZJUSHRTI-UHFFFAOYSA-N
Molecular Weight 280.345 g/mol
SMILES C1(N(c2ccc(cc2C1)SC#N)Cc1ccccc1)=O
SPLASH splash10-0159-9000000000-fbade33c18918fdd0d8e
Source of Spectrum C5-2005-963-2
Wiley ID 1618292