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7-Methyl-9-phenyl-2,5-dihydro-3H-(1,3a,5,6)-tetraazacyclopenta[a]naphthalene-4-thione
SpectraBase Compound ID 1aKTMqgEsGB
InChI InChI=1S/C16H14N4S/c1-10-9-12(11-5-3-2-4-6-11)13-14(18-10)19-16(21)20-8-7-17-15(13)20/h2-6,9H,7-8H2,1H3,(H,18,19,21)
InChIKey ZYWQNIPISBPIMV-UHFFFAOYSA-N
Mol Weight 294.38 g/mol
Molecular Formula C16H14N4S
Exact Mass 294.093918 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1ZNbas60NG
Name 7-Methyl-9-phenyl-2,5-dihydro-3H-(1,3a,5,6)-tetraazacyclopenta[a]naphthalene-4-thione
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14N4S
InChI InChI=1S/C16H14N4S/c1-10-9-12(11-5-3-2-4-6-11)13-14(18-10)19-16(21)20-8-7-17-15(13)20/h2-6,9H,7-8H2,1H3,(H,18,19,21)
InChIKey ZYWQNIPISBPIMV-UHFFFAOYSA-N
Molecular Weight 294.376 g/mol
SMILES N1C(N2C(c3c1nc(cc3-c1ccccc1)C)=NCC2)=S
SPLASH splash10-004i-0090000000-2c4294abb7f98e226214
Source of Spectrum AH-140-577-3
Wiley ID 1696182