For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
9-(2,3-O-isopropylidene-D-ribityl)-6-methylthiopurine
SpectraBase Compound ID 9Q6nvsSZCK4
InChI InChI=1S/C14H20N4O4S/c1-14(2)21-9(11(22-14)8(20)5-19)4-18-7-17-10-12(18)15-6-16-13(10)23-3/h6-9,11,19-20H,4-5H2,1-3H3/t8-,9+,11-/m1/s1
InChIKey HZHUBBHABHJTDA-WCABBAIRSA-N
Mol Weight 340.4 g/mol
Molecular Formula C14H20N4O4S
Exact Mass 340.120526 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 7Kd4wLIjbag
Name 9-(2,3-O-isopropylidene-D-ribityl)-6-methylthiopurine
Alternate Name(s) 1-deoxy-2,3-O-(1-methylethylidene)-1-[6-(methylsulfanyl)-9H-purin-9-yl]-D-ribitol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20N4O4S
InChI InChI=1S/C14H20N4O4S/c1-14(2)21-9(11(22-14)8(20)5-19)4-18-7-17-10-12(18)15-6-16-13(10)23-3/h6-9,11,19-20H,4-5H2,1-3H3/t8-,9+,11-/m1/s1
InChIKey HZHUBBHABHJTDA-WCABBAIRSA-N
Molecular Weight 340.398 g/mol
SMILES O[C@](CO)([C@@]1([C@](C[n]2c3c(c(SC)ncn3)nc2)(OC(C)(C)O1)[H])[H])[H]
SPLASH splash10-014i-9444000000-cdc913c2204b3ff47544
Source of Spectrum F-53-16690-2
Wiley ID 804570