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1-(2-Furylmethyl)-3-(2-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID EMfePLSo2EW
InChI InChI=1S/C17H14N4O3/c1-11-5-2-3-7-13(11)21-15-14(18-10-19-15)16(22)20(17(21)23)9-12-6-4-8-24-12/h2-8,10H,9H2,1H3,(H,18,19)
InChIKey DGOYBDKTDDCUDD-UHFFFAOYSA-N
Mol Weight 322.32 g/mol
Molecular Formula C17H14N4O3
Exact Mass 322.10659 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3WNHFPy0HBq
Name 1-(2-Furylmethyl)-3-(2-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione
Alternate Name(s) 1-(2-furanylmethyl)-3-(2-methylphenyl)-7H-purine-2,6-dione 1-(2-furfuryl)-3-(o-tolyl)-7H-purine-2,6-quinone 1-(2-furylmethyl)-3-(o-tolyl)-7H-purine-2,6-dione 1-(furan-2-ylmethyl)-3-(2-methylphenyl)-7H-purine-2,6-dione Purine-2,6(1H,3H)-dione, 1-(2-furfuryl)-3-(2-methylphenyl)-
CAS Registry Number 184898-44-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14N4O3
InChI InChI=1S/C17H14N4O3/c1-11-5-2-3-7-13(11)21-15-14(18-10-19-15)16(22)20(17(21)23)9-12-6-4-8-24-12/h2-8,10H,9H2,1H3,(H,18,19)
InChIKey DGOYBDKTDDCUDD-UHFFFAOYSA-N
Molecular Weight 322.324 g/mol
SMILES [nH]1cnc2c1C(N(C(N2c1c(C)cccc1)=O)Cc1occc1)=O
SPLASH splash10-001i-9302000000-485237851c97545f8601
Source of Spectrum AD-0-2532-0
Wiley ID 1428275