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6-(2-aminophenyl-1-thio)-9H-[2-tetrahydropyranyl]purine
SpectraBase Compound ID 3FxMRDKS7SH
InChI InChI=1S/C16H17N5OS/c17-10-5-1-2-7-12(10)23-16-13-15(19-9-18-13)20-14(21-16)11-6-3-4-8-22-11/h1-2,5,7,9,11H,3-4,6,8,17H2,(H,18,19,20,21)
InChIKey KPYMGUVIQOPMNI-UHFFFAOYSA-N
Mol Weight 327.41 g/mol
Molecular Formula C16H17N5OS
Exact Mass 327.115381 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KQtmEUn8bhR
Name 6-(2-aminophenyl-1-thio)-9H-[2-tetrahydropyranyl]purine
Alternate Name(s) 2-[(2-tetrahydro-2H-pyran-2-yl-9H-purin-6-yl)sulfanyl]aniline 2-[(2-tetrahydro-2H-pyran-2-yl-9H-purin-6-yl)sulfanyl]phenylamine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17N5OS
InChI InChI=1S/C16H17N5OS/c17-10-5-1-2-7-12(10)23-16-13-15(19-9-18-13)20-14(21-16)11-6-3-4-8-22-11/h1-2,5,7,9,11H,3-4,6,8,17H2,(H,18,19,20,21)
InChIKey KPYMGUVIQOPMNI-UHFFFAOYSA-N
Molecular Weight 327.406 g/mol
SMILES [nH]1cnc2c1nc(nc2Sc1c(cccc1)N)C1OCCCC1
SPLASH splash10-00kf-2090000000-c802f660a086b7a24bbb
Source of Spectrum Y-26-1521-6
Wiley ID 1325426