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5-Allyl-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
SpectraBase Compound ID IY6u3VA7snX
InChI InChI=1S/C12H10N4S/c1-2-7-16-9-6-4-3-5-8(9)10-11(16)13-12(17)15-14-10/h2-6H,1,7H2,(H,13,15,17)
InChIKey DOVCOZLCUCPOIE-UHFFFAOYSA-N
Mol Weight 242.3 g/mol
Molecular Formula C12H10N4S
Exact Mass 242.062618 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CWYSan69FKs
Name 5-Allyl-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
CAS Registry Number 247571-59-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10N4S
InChI InChI=1S/C12H10N4S/c1-2-7-16-9-6-4-3-5-8(9)10-11(16)13-12(17)15-14-10/h2-6H,1,7H2,(H,13,15,17)
InChIKey DOVCOZLCUCPOIE-UHFFFAOYSA-N
Molecular Weight 242.300 g/mol
SMILES Sc1nc2c(c3ccccc3[n]2CC=C)nn1
SPLASH splash10-0006-1950000000-bd3fc5aed1b780ff5c3f
Source of Spectrum AD-0-2532-0
Synonyms 1,2,4-Triazino[5,6-b]indole-3-thiol, 5-allyl- 5-Allyl-2H-[1,2,4]triazino[5,6-b]indole-3-thione 5-Allyl-2H-[1,2,4]triazin[5,6-b]indole-3-thione 5-Prop-2-enyl-2H-[1,2,4]triazino[5,6-b]indole-3-thione
Wiley ID 1431248