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2-Amino-4-(3-fluorophenyl)-6-(hydroxymethyl)-8-oxo-4H,8H-pyrano[3,2-b]pyran-3-carbonitrile
SpectraBase Compound ID KDQglVyftgn
InChI InChI=1S/C16H11FN2O4/c17-9-3-1-2-8(4-9)13-11(6-18)16(19)23-14-12(21)5-10(7-20)22-15(13)14/h1-5,13,20H,7,19H2
InChIKey WMZOQTJCNJRFMC-UHFFFAOYSA-N
Mol Weight 314.27 g/mol
Molecular Formula C16H11FN2O4
Exact Mass 314.070285 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7HLkHudyyMa
Name 2-Amino-4-(3-fluorophenyl)-6-(hydroxymethyl)-8-oxo-4H,8H-pyrano[3,2-b]pyran-3-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11FN2O4
InChI InChI=1S/C16H11FN2O4/c17-9-3-1-2-8(4-9)13-11(6-18)16(19)23-14-12(21)5-10(7-20)22-15(13)14/h1-5,13,20H,7,19H2
InChIKey WMZOQTJCNJRFMC-UHFFFAOYSA-N
Molecular Weight 314.272 g/mol
SMILES OCC=1OC2=C(OC(=C(C2c2cccc(c2)F)C#N)N)C(C1)=O
SPLASH splash10-014i-8591000000-0c452b3e9bfa54836da3
Source of Spectrum IY-2-4982-7
Synonyms Pyrano[3,2-b]pyran-3-carbonitrile, 2-amino-4-(3-fluorophenyl)-4,8-dihydro-6-(hydroxymethyl)-8-oxo- 2-Amino-4-(3-fluorophenyl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile 2-Azanyl-4-(3-fluorophenyl)-6-(hydroxymethyl)-8-oxidanylidene-4H-pyrano[3,2-b]pyran-3-carbonitrile
Wiley ID 1657810