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N-{2-(Phenylthio)naphthalen-1-yl}pyrimidin-2-amine
SpectraBase Compound ID 71thYeEjcXt
InChI InChI=1S/C20H15N3S/c1-2-8-16(9-3-1)24-18-12-11-15-7-4-5-10-17(15)19(18)23-20-21-13-6-14-22-20/h1-14H,(H,21,22,23)
InChIKey ZVZBULSTXBLJRU-UHFFFAOYSA-N
Mol Weight 329.42 g/mol
Molecular Formula C20H15N3S
Exact Mass 329.098669 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7QAjrIdNYMA
Name N-{2-(Phenylthio)naphthalen-1-yl}pyrimidin-2-amine
Appearance Pale yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H15N3S
InChI InChI=1S/C20H15N3S/c1-2-8-16(9-3-1)24-18-12-11-15-7-4-5-10-17(15)19(18)23-20-21-13-6-14-22-20/h1-14H,(H,21,22,23)
InChIKey ZVZBULSTXBLJRU-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/chem.201603092
Molecular Weight 329.421 g/mol
Quality 85
Reported Formula C20H15N3S
SMILES N(C1=C(SC2=CC=CC=C2)C=CC2=C1C=CC=C2)C1=NC=CC=N1
SPLASH splash10-00di-0190000000-afd83b7583e812cd8a99
Source of Spectrum QE-22-SM10-3ia (DOI: 10.1002/chem.201603092)
Wiley ID 1905119