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3-(3-(5-Nitrofuran-2-yl)acryloyl)-2H-chromen-2-one
SpectraBase Compound ID FhHNy5s6aRB
InChI InChI=1S/C16H9NO6/c18-13(7-5-11-6-8-15(22-11)17(20)21)12-9-10-3-1-2-4-14(10)23-16(12)19/h1-9H/b7-5+
InChIKey XMMBXFCEJFZLLL-FNORWQNLSA-N
Mol Weight 311.25 g/mol
Molecular Formula C16H9NO6
Exact Mass 311.042987 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EbC1g2ftHrh
Name 3-(3-(5-Nitrofuran-2-yl)acryloyl)-2H-chromen-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C16H9NO6
InChI InChI=1S/C16H9NO6/c18-13(7-5-11-6-8-15(22-11)17(20)21)12-9-10-3-1-2-4-14(10)23-16(12)19/h1-9H/b7-5+
InChIKey XMMBXFCEJFZLLL-FNORWQNLSA-N
Molecular Weight 311.249 g/mol
SMILES C=1(C(Oc2c(C1)cccc2)=O)C(\C=C\c1oc(N(=O)=O)cc1)=O
SPLASH splash10-014i-0094000000-3e3180f6b63d858f0507
Source of Spectrum Y-47-185-3b
Synonyms 3-[(E)-3-(5-nitro-2-furanyl)-1-oxoprop-2-enyl]-1-benzopyran-2-one 3-[(E)-3-(5-nitro-2-furyl)prop-2-enoyl]chromen-2-one 3-[(E)-3-(5-nitrofuran-2-yl)prop-2-enoyl]chromen-2-one
Wiley ID 1667117