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Cyclohexanone, 2-(9-ethyl-9H-purin-6-yl)-
SpectraBase Compound ID 1tNPwhrC7M5
InChI InChI=1S/C13H16N4O/c1-2-17-8-16-12-11(14-7-15-13(12)17)9-5-3-4-6-10(9)18/h7-9H,2-6H2,1H3
InChIKey ARPKLEADINEHGM-UHFFFAOYSA-N
Mol Weight 244.3 g/mol
Molecular Formula C13H16N4O
Exact Mass 244.132411 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7MQRxqiiY1X
Name Cyclohexanone, 2-(9-ethyl-9H-purin-6-yl)-
Alternate Name(s) 2-(9-Ethyl-9H-purin-6-yl)cyclohexanone 6-Cyclohexanon-2-yl-9-ethylpurine
CAS Registry Number 95589-57-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N4O
InChI InChI=1S/C13H16N4O/c1-2-17-8-16-12-11(14-7-15-13(12)17)9-5-3-4-6-10(9)18/h7-9H,2-6H2,1H3
InChIKey ARPKLEADINEHGM-UHFFFAOYSA-N
Molecular Weight 244.298 g/mol
SMILES c12nc[n](c2ncnc1C1C(=O)CCCC1)CC
SPLASH splash10-002u-0940000000-6b273b8610305e5f5fc8
Source of Spectrum J-50-5073-5
Wiley ID 1246914