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9-(p-toluenesulfonyl)adenine
SpectraBase Compound ID 68RLSoAi48a
InChI InChI=1S/C12H11N5O2S/c1-8-2-4-9(5-3-8)20(18,19)17-7-16-10-11(13)14-6-15-12(10)17/h2-7H,1H3,(H2,13,14,15)
InChIKey ANALZTZFWPGIRH-UHFFFAOYSA-N
Mol Weight 289.31 g/mol
Molecular Formula C12H11N5O2S
Exact Mass 289.063346 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LXsruH5ML9u
Name 9-(p-toluenesulfonyl)adenine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11N5O2S
InChI InChI=1S/C12H11N5O2S/c1-8-2-4-9(5-3-8)20(18,19)17-7-16-10-11(13)14-6-15-12(10)17/h2-7H,1H3,(H2,13,14,15)
InChIKey ANALZTZFWPGIRH-UHFFFAOYSA-N
Instrument Name Finnigan 2001 DD
Ionization Type EI
Literature Reference DOI 10.1002/rcm.930
Molecular Weight 289.313 g/mol
SMILES Nc1c2c(ncn1)[n](cn2)S(=O)(=O)c1ccc(cc1)C
SPLASH splash10-0006-1090000000-ea2fa561bcce237e65bc
Source of Spectrum RCM-17-378-1
Wiley ID 1836322