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6-(7-Amino-3H-V-triazolo[4,5-D]pyrimidin-3-yl)hexanoic acid

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6-(7-Amino-3H-V-triazolo[4,5-D]pyrimidin-3-yl)hexanoic acid
SpectraBase Compound ID J4nkcKPYDv5
InChI InChI=1S/C10H14N6O2/c11-9-8-10(13-6-12-9)16(15-14-8)5-3-1-2-4-7(17)18/h6H,1-5H2,(H,17,18)(H2,11,12,13)
InChIKey CXVUNZFDFYULQF-UHFFFAOYSA-N
Mol Weight 250.26 g/mol
Molecular Formula C10H14N6O2
Exact Mass 250.117824 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3jlr9beCu68
Name 6-(7-Amino-3H-V-triazolo[4,5-D]pyrimidin-3-yl)hexanoic acid
CAS Registry Number 55739-65-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H14N6O2
InChI InChI=1S/C10H14N6O2/c11-9-8-10(13-6-12-9)16(15-14-8)5-3-1-2-4-7(17)18/h6H,1-5H2,(H,17,18)(H2,11,12,13)
InChIKey CXVUNZFDFYULQF-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference E. Kraas, G. Jung, Chem. Ber. 108, 1111 (1975).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6