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3,7-Dimethyl-1-propargyl-2,3,5,6-tetrahydropurine-2,6-dione

View entire compound with spectra: 1 MS (GC)

3,7-Dimethyl-1-propargyl-2,3,5,6-tetrahydropurine-2,6-dione
SpectraBase Compound ID BwUyVl4aj8e
InChI InChI=1S/C10H10N4O2/c1-4-5-14-9(15)7-8(11-6-12(7)2)13(3)10(14)16/h1,6H,5H2,2-3H3
InChIKey IORPOFJLSIHJOG-UHFFFAOYSA-N
Mol Weight 218.22 g/mol
Molecular Formula C10H10N4O2
Exact Mass 218.080376 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JkjbGws8NUw
Name 3,7-Dimethyl-1-propargyl-2,3,5,6-tetrahydropurine-2,6-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10N4O2
InChI InChI=1S/C10H10N4O2/c1-4-5-14-9(15)7-8(11-6-12(7)2)13(3)10(14)16/h1,6H,5H2,2-3H3
InChIKey IORPOFJLSIHJOG-UHFFFAOYSA-N
Molecular Weight 218.216 g/mol
SMILES c12c(C(=O)N(C(N2C)=O)CC#C)[n](C)cn1
SPLASH splash10-014i-0290000000-6c306d350dd832007970
Source of Spectrum F-56-7557-2
Synonyms 3,7-Dimethyl-1-prop-2-ynyl-3,7-dihydro-purine-2,6-dione 3,7-Dimethyl-1-prop-2-ynylpurine-2,6-dione 3,7-Dimethyl-1-prop-2-ynyl-purine-2,6-dione
Wiley ID 858688