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3-(3-Ethyl-4-oxidanidyl-6-phenyl-1,2,4-triazin-4-ium-5-yl)-1-methyl-indole
SpectraBase Compound ID BT2NV2BRX5c
InChI InChI=1S/C20H18N4O/c1-3-18-21-22-19(14-9-5-4-6-10-14)20(24(18)25)16-13-23(2)17-12-8-7-11-15(16)17/h4-13H,3H2,1-2H3
InChIKey WWXSUOPFQHBWTG-UHFFFAOYSA-N
Mol Weight 330.39 g/mol
Molecular Formula C20H18N4O
Exact Mass 330.148061 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bx4Of60yt2l
Name 3-(3-Ethyl-4-oxidanidyl-6-phenyl-1,2,4-triazin-4-ium-5-yl)-1-methyl-indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18N4O
InChI InChI=1S/C20H18N4O/c1-3-18-21-22-19(14-9-5-4-6-10-14)20(24(18)25)16-13-23(2)17-12-8-7-11-15(16)17/h4-13H,3H2,1-2H3
InChIKey WWXSUOPFQHBWTG-UHFFFAOYSA-N
Molecular Weight 330.391 g/mol
SMILES c1(-c2[n+](c(CC)nnc2-c2ccccc2)[O-])c[n](C)c2c1cccc2
SPLASH splash10-001i-0339000000-c2fc5335d86ab3ce1b8d
Source of Spectrum O1-34-405-14
Synonyms 3-(3-Ethyl-4-oxido-6-phenyl-1,2,4-triazin-4-ium-5-yl)-1-methyl-indole
Wiley ID 819399