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7H-purine-6-carboxylic acid ethyl ester
SpectraBase Compound ID L6ySKnFXbq5
InChI InChI=1S/C8H8N4O2/c1-2-14-8(13)6-5-7(11-3-9-5)12-4-10-6/h3-4H,2H2,1H3,(H,9,10,11,12)
InChIKey MPKAIUJOHFMCPO-UHFFFAOYSA-N
Mol Weight 192.18 g/mol
Molecular Formula C8H8N4O2
Exact Mass 192.064726 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AztOT46STTR
Name 7H-purine-6-carboxylic acid ethyl ester
CAS Registry Number 40769-66-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8N4O2
InChI InChI=1S/C8H8N4O2/c1-2-14-8(13)6-5-7(11-3-9-5)12-4-10-6/h3-4H,2H2,1H3,(H,9,10,11,12)
InChIKey MPKAIUJOHFMCPO-UHFFFAOYSA-N
Molecular Weight 192.178 g/mol
SMILES [nH]1c2ncnc(c2nc1)C(OCC)=O
SPLASH splash10-00di-0900000000-8734377e7736c96c931f
Source of Spectrum Y-26-1865-1
Synonyms Ethyl 7H-purine-6-carboxylate Ethyl 9H-purine-6-carboxylate
Wiley ID 1187962