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4-(1-benzofuran-2-yl)-2-chloranyl-6-(1-methylpyrrol-2-yl)pyrimidine
SpectraBase Compound ID 96RL9Z45cK0
InChI InChI=1S/C17H12ClN3O/c1-21-8-4-6-14(21)12-10-13(20-17(18)19-12)16-9-11-5-2-3-7-15(11)22-16/h2-10H,1H3
InChIKey HURMIDNCFWDKTE-UHFFFAOYSA-N
Mol Weight 309.76 g/mol
Molecular Formula C17H12ClN3O
Exact Mass 309.06689 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6zbDoDwdUJB
Name 4-(1-benzofuran-2-yl)-2-chloranyl-6-(1-methylpyrrol-2-yl)pyrimidine
CAS Registry Number 131022-72-5
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12ClN3O
InChI InChI=1S/C17H12ClN3O/c1-21-8-4-6-14(21)12-10-13(20-17(18)19-12)16-9-11-5-2-3-7-15(11)22-16/h2-10H,1H3
InChIKey HURMIDNCFWDKTE-UHFFFAOYSA-N
Molecular Weight 309.756 g/mol
SMILES c1(oc2ccccc2c1)-c1nc(Cl)nc(c1)-c1[n](ccc1)C
SPLASH splash10-0a4i-0009000000-f59f2c073fbccb6ca443
Source of Spectrum Y-27-1397-20
Synonyms 4-(1-benzofuran-2-yl)-2-chloro-6-(1-methylpyrrol-2-yl)pyrimidine 4-(2-benzofuranyl)-2-chloro-6-(1-methyl-2-pyrrolyl)pyrimidine 4-(benzofuran-2-yl)-2-chloro-6-(1-methylpyrrol-2-yl)pyrimidine
Wiley ID 1310629