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Cyclohexanone, 2-(9-ethyl-9H-purin-6-yl)-6-methyl-
SpectraBase Compound ID BDgRGCaCiad
InChI InChI=1S/C14H18N4O/c1-3-18-8-17-12-11(15-7-16-14(12)18)10-6-4-5-9(2)13(10)19/h7-10H,3-6H2,1-2H3
InChIKey ZPWCGIQCVWKCQC-UHFFFAOYSA-N
Mol Weight 258.32 g/mol
Molecular Formula C14H18N4O
Exact Mass 258.148061 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8f3tdcqvpg9
Name Cyclohexanone, 2-(9-ethyl-9H-purin-6-yl)-6-methyl-
CAS Registry Number 95589-60-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18N4O
InChI InChI=1S/C14H18N4O/c1-3-18-8-17-12-11(15-7-16-14(12)18)10-6-4-5-9(2)13(10)19/h7-10H,3-6H2,1-2H3
InChIKey ZPWCGIQCVWKCQC-UHFFFAOYSA-N
Molecular Weight 258.325 g/mol
SMILES c12nc[n](c2ncnc1C1C(=O)C(C)CCC1)CC
SPLASH splash10-004i-0690000000-f3cf7d8a37624c0bb348
Source of Spectrum J-50-5074-8
Synonyms 2-(9-Ethyl-9H-purin-6-yl)-6-methylcyclohexanone 6-(6-Methylcyclohexanon-2-yl)-9-ethylpurine
Wiley ID 1261676