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6-(methylthio)-9-[2-[1-(phenylmethyl)-3-pyrrolidinyl]ethyl]purine
SpectraBase Compound ID I0QP2UWxP18
InChI InChI=1S/C19H23N5S/c1-25-19-17-18(20-13-21-19)24(14-22-17)10-8-16-7-9-23(12-16)11-15-5-3-2-4-6-15/h2-6,13-14,16H,7-12H2,1H3
InChIKey LWRPHPWLRMUKDD-UHFFFAOYSA-N
Mol Weight 353.49 g/mol
Molecular Formula C19H23N5S
Exact Mass 353.167417 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KS9PG7r7R5N
Name 6-(methylthio)-9-[2-[1-(phenylmethyl)-3-pyrrolidinyl]ethyl]purine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23N5S
InChI InChI=1S/C19H23N5S/c1-25-19-17-18(20-13-21-19)24(14-22-17)10-8-16-7-9-23(12-16)11-15-5-3-2-4-6-15/h2-6,13-14,16H,7-12H2,1H3
InChIKey LWRPHPWLRMUKDD-UHFFFAOYSA-N
Molecular Weight 353.488 g/mol
SMILES c12nc[n](c2ncnc1SC)CCC1CN(Cc2ccccc2)CC1
SPLASH splash10-0006-9031000000-83ab2be804b500ac79e3
Source of Spectrum C5-2002-914-7
Synonyms 6-Methylsulfanyl-9-[2-[1-(phenylmethyl)pyrrolidin-3-yl]ethyl]purine 9-[2-(1-benzylpyrrolidin-3-yl)ethyl]-6-(methylthio)purine 9-[2-(1-benzylpyrrolidin-3-yl)ethyl]-6-methylsulfanyl-purine
Wiley ID 1614624