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2-(allylamino)-3-(4-chlorophenyl)pteridin-4-one
SpectraBase Compound ID 57yPnoDuS29
InChI InChI=1S/C15H12ClN5O/c1-2-7-19-15-20-13-12(17-8-9-18-13)14(22)21(15)11-5-3-10(16)4-6-11/h2-6,8-9H,1,7H2,(H,18,19,20)
InChIKey UFQKCAFNMXTRLH-UHFFFAOYSA-N
Mol Weight 313.75 g/mol
Molecular Formula C15H12ClN5O
Exact Mass 313.073038 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7zZQr98YTgt
Name 2-(allylamino)-3-(4-chlorophenyl)pteridin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12ClN5O
InChI InChI=1S/C15H12ClN5O/c1-2-7-19-15-20-13-12(17-8-9-18-13)14(22)21(15)11-5-3-10(16)4-6-11/h2-6,8-9H,1,7H2,(H,18,19,20)
InChIKey UFQKCAFNMXTRLH-UHFFFAOYSA-N
Molecular Weight 313.748 g/mol
SMILES N(C=1N(C(c2c(nccn2)N1)=O)c1ccc(cc1)Cl)CC=C
SPLASH splash10-03di-0139000000-f3dd7354acd8c8293abb
Source of Spectrum KC-0-252-12
Synonyms 3-(4-Chlorophenyl)-2-(prop-2-enylamino)-4-pteridinone 3-(4-Chlorophenyl)-2-(prop-2-enylamino)pteridin-4-one
Wiley ID 785117