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7H-Purine-8-carboxaldehyde

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

7H-Purine-8-carboxaldehyde
SpectraBase Compound ID CtAhgkI7D69
InChI InChI=1S/C6H4N4O/c11-2-5-9-4-1-7-3-8-6(4)10-5/h1-3H,(H,7,8,9,10)
InChIKey CBAXVPCTBZORMR-UHFFFAOYSA-N
Mol Weight 148.12 g/mol
Molecular Formula C6H4N4O
Exact Mass 148.038511 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3GbKiq2OMKq
Name 1H-Purine-8-carboxaldehyde
CAS Registry Number 56805-26-6
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H4N4O
InChI InChI=1S/C6H4N4O/c11-2-5-9-4-1-7-3-8-6(4)10-5/h1-3H,(H,7,8,9,10)
InChIKey CBAXVPCTBZORMR-UHFFFAOYSA-N
Molecular Weight 148.125 g/mol
SMILES [nH]1c(nc2ncncc12)C=O
SPLASH splash10-014j-9500000000-5c7b8383ccd10ccc7535
Source of Spectrum EP-7504-0-0
Synonyms 1H-Purine-8-carbaldehyde 7H-purine-8-carbaldehyde 7H-Purine-8-carboxaldehyde
Wiley ID 1145140