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6,7-DIHYDRO-7-OXO-3H-v-TRIAZOLO[4,5-d]PYRIMIDINE-3-HEXANOIC ACID

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6,7-DIHYDRO-7-OXO-3H-v-TRIAZOLO[4,5-d]PYRIMIDINE-3-HEXANOIC ACID
SpectraBase Compound ID 9qbx43LGZBn
InChI InChI=1S/C10H13N5O3/c16-7(17)4-2-1-3-5-15-9-8(13-14-15)10(18)12-6-11-9/h6H,1-5H2,(H,16,17)(H,11,12,18)
InChIKey LQOBQYHHJGGUMV-UHFFFAOYSA-N
Mol Weight 251.25 g/mol
Molecular Formula C10H13N5O3
Exact Mass 251.101839 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4mhkgAZ3AIS
Name 6,7-DIHYDRO-7-OXO-3H-v-TRIAZOLO[4,5-d]PYRIMIDINE-3-HEXANOIC ACID
Source of Sample E. Kraas, G. Jung Chem. Ber. 108, 1111(1975)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13N5O3
InChI InChI=1S/C10H13N5O3/c16-7(17)4-2-1-3-5-15-9-8(13-14-15)10(18)12-6-11-9/h6H,1-5H2,(H,16,17)(H,11,12,18)
InChIKey LQOBQYHHJGGUMV-UHFFFAOYSA-N
Molecular Weight 251.25
Solvent Dimethyl sulfoxide-d6; Reference=TMS; Temperature=Ambient Spectrometer= Bruker HX-90