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N(9)-Ethynyladenine

View entire compound with spectra: 1 MS (GC)

N(9)-Ethynyladenine
SpectraBase Compound ID 25VVOBKBKUg
InChI InChI=1S/C7H5N5/c1-2-12-4-11-5-6(8)9-3-10-7(5)12/h1,3-4H,(H2,8,9,10)
InChIKey WTEIWZLDAOAOGZ-UHFFFAOYSA-N
Mol Weight 159.15 g/mol
Molecular Formula C7H5N5
Exact Mass 159.054495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGK2GQZOCB5
Name N(9)-Ethynyladenine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H5N5
InChI InChI=1S/C7H5N5/c1-2-12-4-11-5-6(8)9-3-10-7(5)12/h1,3-4H,(H2,8,9,10)
InChIKey WTEIWZLDAOAOGZ-UHFFFAOYSA-N
Molecular Weight 159.152 g/mol
SMILES Nc1c2nc[n](c2ncn1)C#C
SPLASH splash10-0a4i-0900000000-4f7b78499458c7866fbf
Source of Spectrum KC-0-1096-30
Synonyms 9-Ethynyl-9H-purin-6-amine 9-Ethynyl-9H-purin-6-ylamine 9-Ethynyl-6-purinamine 9-Ethynylpurin-6-amine
Wiley ID 781240