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Benzyl 5H-[1,2,4]triazino[5,6-b]indol-3-yl sulfide
SpectraBase Compound ID OOMmc2FGYX
InChI InChI=1S/C16H12N4S/c1-2-6-11(7-3-1)10-21-16-18-15-14(19-20-16)12-8-4-5-9-13(12)17-15/h1-9H,10H2,(H,17,18,20)
InChIKey WBVHPGIBBFVLKN-UHFFFAOYSA-N
Mol Weight 292.36 g/mol
Molecular Formula C16H12N4S
Exact Mass 292.078268 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AieX4chEY2E
Name Benzyl 5H-[1,2,4]triazino[5,6-b]indol-3-yl sulfide
CAS Registry Number 73718-26-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12N4S
InChI InChI=1S/C16H12N4S/c1-2-6-11(7-3-1)10-21-16-18-15-14(19-20-16)12-8-4-5-9-13(12)17-15/h1-9H,10H2,(H,17,18,20)
InChIKey WBVHPGIBBFVLKN-UHFFFAOYSA-N
Molecular Weight 292.360 g/mol
SMILES [nH]1c2ccccc2c2c1nc(nn2)SCc1ccccc1
SPLASH splash10-0006-9420000000-7b725e31bd0ac52aada1
Source of Spectrum AD-0-2532-0
Synonyms 1,2,4-Triazino[5,6-b]indole, 2-benzylthio- 3-(benzylthio)-5H-[1,2,4]triazin[5,6-b]indole 3-(Phenylmethylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole 3-(Phenylmethylthio)-5H-[1,2,4]triazino[5,6-b]indole 3-Benzylsulfanyl-5H-[1,2,4]triazino[5,6-b]indole
Wiley ID 1421360