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D-Xylitol, 1-C-(6-amino-9H-purin-9-yl)-2,5-anhydro-1-S-ethyl-1-thio-
SpectraBase Compound ID 7F5ODNGZM7y
InChI InChI=1S/C12H17N5O3S/c1-2-21-12(9-8(19)6(18)3-20-9)17-5-16-7-10(13)14-4-15-11(7)17/h4-6,8-9,12,18-19H,2-3H2,1H3,(H2,13,14,15)
InChIKey GCYWSPNEHXURTA-UHFFFAOYSA-N
Mol Weight 311.36 g/mol
Molecular Formula C12H17N5O3S
Exact Mass 311.105211 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2rR0Uvmi5l2
Name D-Xylitol, 1-C-(6-amino-9H-purin-9-yl)-2,5-anhydro-1-S-ethyl-1-thio-
Alternate Name(s) 1-c-(6-Amino-9H-purin-9-yl)-2,5-anhydro-1-S-ethyl-1-thiopentitol 2-[(6-aminopurin-9-yl)-(ethylthio)methyl]oxolane-3,4-diol 2-[(6-aminopurin-9-yl)-ethylsulfanyl-methyl]oxolane-3,4-diol 2-[(6-aminopurin-9-yl)-ethylsulfanyl-methyl]tetrahydrofuran-3,4-diol 2-[adenin-9-yl-(ethylthio)methyl]tetrahydrofuran-3,4-diol
CAS Registry Number 40031-68-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17N5O3S
InChI InChI=1S/C12H17N5O3S/c1-2-21-12(9-8(19)6(18)3-20-9)17-5-16-7-10(13)14-4-15-11(7)17/h4-6,8-9,12,18-19H,2-3H2,1H3,(H2,13,14,15)
InChIKey GCYWSPNEHXURTA-UHFFFAOYSA-N
Molecular Weight 311.360 g/mol
SMILES OC1C(C(C([n]2c3c(c(ncn3)N)nc2)SCC)OC1)O
SPLASH splash10-0f79-0950000000-9f3f09eff148604d48d8
Source of Spectrum AU-24-241-8
Wiley ID 1312226