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Pyrido[3,4-b]pyrazine, 2-[(phenylthio)methyl]-
SpectraBase Compound ID LWBFuUDKE8D
InChI InChI=1S/C14H11N3S/c1-2-4-12(5-3-1)18-10-11-8-16-14-9-15-7-6-13(14)17-11/h1-9H,10H2
InChIKey VOOPBEHECIJOFV-UHFFFAOYSA-N
Mol Weight 253.32 g/mol
Molecular Formula C14H11N3S
Exact Mass 253.067369 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4ZGrJAJeYy
Name Pyrido[3,4-b]pyrazine, 2-[(phenylthio)methyl]-
CAS Registry Number 115909-70-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11N3S
InChI InChI=1S/C14H11N3S/c1-2-4-12(5-3-1)18-10-11-8-16-14-9-15-7-6-13(14)17-11/h1-9H,10H2
InChIKey VOOPBEHECIJOFV-UHFFFAOYSA-N
Molecular Weight 253.323 g/mol
SMILES c12nc(cnc2cncc1)CSc1ccccc1
SPLASH splash10-0pi3-9240000000-8d5f09c6f05eff6882c7
Source of Spectrum F-44-1725-0
Synonyms 2-(Phenylthiomethyl)pyrido[3,4-b]pyrazine 2-[(phenylsulfanyl)methyl]pyrido[3,4-b]pyrazine phenyl pyrido[3,4-b]pyrazin-2-ylmethyl sulfide
Wiley ID 1256773