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5,11-Imino-5H,11H-[1,5]dithiocino[2,3-b:6,7-b']dipyridine, 13-(phenylmethyl)-
SpectraBase Compound ID 8yAl9dHNCP9
InChI InChI=1S/C19H15N3S2/c1-2-6-13(7-3-1)12-22-18-14-8-4-10-20-16(14)23-19(22)15-9-5-11-21-17(15)24-18/h1-11,18-19H,12H2/t18-,19-/m1/s1
InChIKey NKVWLXKGVJLOHY-RTBURBONSA-N
Mol Weight 349.47 g/mol
Molecular Formula C19H15N3S2
Exact Mass 349.07074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1JpkE1zrBA2
Name 5,11-Imino-5H,11H-[1,5]dithiocino[2,3-b:6,7-b']dipyridine, 13-(phenylmethyl)-
CAS Registry Number 72397-23-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H15N3S2
InChI InChI=1S/C19H15N3S2/c1-2-6-13(7-3-1)12-22-18-14-8-4-10-20-16(14)23-19(22)15-9-5-11-21-17(15)24-18/h1-11,18-19H,12H2/t18-,19-/m1/s1
InChIKey NKVWLXKGVJLOHY-RTBURBONSA-N
Molecular Weight 349.470 g/mol
SMILES [C@@]12(N([C@@](c3c(S2)nccc3)(Sc2ncccc12)[H])Cc1ccccc1)[H]
SPLASH splash10-0a4u-6971000000-293390531fe23b45f63e
Source of Spectrum F-35-872-0
Synonyms 13-Benzyl-5,11-imino-5H,11H-dipyrido[2,3-b:2',3'-f][1,5]dithiocine 17-benzyl-8,16-dithia-6,14,17-triazatetracyclo[7.7.1.0(2,7).0(10,15)]heptadeca-2,4,6,10,12,14-hexaene
Wiley ID 1341355