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2-Amino-4-(2-chlorophenyl)-5,7-dihydroxy-4H-chromene-3-carbonitrile
SpectraBase Compound ID 5oa7BseIPwC
InChI InChI=1S/C16H11ClN2O3/c17-11-4-2-1-3-9(11)14-10(7-18)16(19)22-13-6-8(20)5-12(21)15(13)14/h1-6,14,20-21H,19H2
InChIKey JALZTMFDIZEJBA-UHFFFAOYSA-N
Mol Weight 314.73 g/mol
Molecular Formula C16H11ClN2O3
Exact Mass 314.04582 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C4I4ERz63Rv
Name 2-Amino-4-(2-chlorophenyl)-5,7-dihydroxy-4H-chromene-3-carbonitrile
Appearance White powder
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Exact Mass 314.045819919 u
Formula C16H11ClN2O3
InChI InChI=1S/C16H11ClN2O3/c17-11-4-2-1-3-9(11)14-10(7-18)16(19)22-13-6-8(20)5-12(21)15(13)14/h1-6,14,20-21H,19H2
InChIKey JALZTMFDIZEJBA-UHFFFAOYSA-N
Instrument Name Agilent Technology
Ionization Type EI
Literature Reference DOI 10.1002/bkcs.12526
Molecular Weight 314.728 g/mol
Quality 691
SMILES NC=1OC2=C(C(=CC(=C2)O)O)C(C1C#N)C1=C(C=CC=C1)Cl
SPLASH splash10-0udi-5793000000-18c5025360451433b58b
Source of Spectrum QB-43-SM25-4h (DOI: 10.1002/bkcs.12526)
Wiley ID 1898107