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3,7-Diethyl-1-methylxanthine
SpectraBase Compound ID I0aALPHKN0i
InChI InChI=1S/C10H14N4O2/c1-4-13-6-11-8-7(13)9(15)12(3)10(16)14(8)5-2/h6H,4-5H2,1-3H3
InChIKey CZOUQPDHLMHRNX-UHFFFAOYSA-N
Mol Weight 222.25 g/mol
Molecular Formula C10H14N4O2
Exact Mass 222.111676 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 43jDku7Btju
Name 1H-Purine-2,6-dione, 3,7-diethyl-3,7-dihydro-1-methyl-
CAS Registry Number 53432-05-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14N4O2
InChI InChI=1S/C10H14N4O2/c1-4-13-6-11-8-7(13)9(15)12(3)10(16)14(8)5-2/h6H,4-5H2,1-3H3
InChIKey CZOUQPDHLMHRNX-UHFFFAOYSA-N
Molecular Weight 222.248 g/mol
SMILES CC[n]1c2c(N(CC)C(=O)N(C2=O)C)nc1
SPLASH splash10-0fk9-5940000000-3ad848b653fb29c18047
Source of Spectrum BA-0-190-0
Synonyms 3,7-Diethyl-1-methyl-3,7-dihydro-1H-purine-2,6-dione 3,7-Diethyl-1-methyl-purine-2,6-dione 3,7-Diethyl-1-methyl-xanthine
Wiley ID 28782