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2-{[(2,2,6,6-Tetramethyl-1,2,3,6-tetrahydropyridin-4-yl)methyl]thio}quinazolin-4(3H)-one
SpectraBase Compound ID IaPP0WmS7Ty
InChI InChI=1S/C18H23N3OS/c1-17(2)9-12(10-18(3,4)21-17)11-23-16-19-14-8-6-5-7-13(14)15(22)20-16/h5-9,21H,10-11H2,1-4H3,(H,19,20,22)
InChIKey YQOIFKDZIBXTGQ-UHFFFAOYSA-N
Mol Weight 329.46 g/mol
Molecular Formula C18H23N3OS
Exact Mass 329.156184 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5eUW0aZWDYj
Name 2-{[(2,2,6,6-Tetramethyl-1,2,3,6-tetrahydropyridin-4-yl)methyl]thio}quinazolin-4(3H)-one
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 329.156183546 u
Formula C18H23N3OS
InChI InChI=1S/C18H23N3OS/c1-17(2)9-12(10-18(3,4)21-17)11-23-16-19-14-8-6-5-7-13(14)15(22)20-16/h5-9,21H,10-11H2,1-4H3,(H,19,20,22)
InChIKey YQOIFKDZIBXTGQ-UHFFFAOYSA-N
Instrument Name VG TRIO-2
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0004.512
Quality 73
SMILES N1C(C=C(CSC2=NC3=C(C(N2)=O)C=CC=C3)CC1(C)C)(C)C
SPLASH splash10-0079-0901000000-225fde9f263ceac42aae
Source of Spectrum ARK-2003-129-13 (DOI: 10.3998/ark.5550190.0004.512)
Wiley ID 1899959