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2-[3-ethoxy-5-iodo-4-(prop-2-yn-1-yloxy)phenyl]-3,4-dihydro-2H-1,3-benzoxazin-4-one
SpectraBase Compound ID AlFidX7zx3s
InChI InChI=1S/C19H16INO4/c1-3-9-24-17-14(20)10-12(11-16(17)23-4-2)19-21-18(22)13-7-5-6-8-15(13)25-19/h1,5-8,10-11,19H,4,9H2,2H3,(H,21,22)
InChIKey CPVVXWKTZASOIS-UHFFFAOYSA-N
Mol Weight 449.24 g/mol
Molecular Formula C19H16INO4
Exact Mass 449.012403 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F78FOAbOQwj
Name 2-[3-ethoxy-5-iodo-4-(prop-2-yn-1-yloxy)phenyl]-3,4-dihydro-2H-1,3-benzoxazin-4-one
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Formula C19H16INO4
InChI InChI=1S/C19H16INO4/c1-3-9-24-17-14(20)10-12(11-16(17)23-4-2)19-21-18(22)13-7-5-6-8-15(13)25-19/h1,5-8,10-11,19H,4,9H2,2H3,(H,21,22)
InChIKey CPVVXWKTZASOIS-UHFFFAOYSA-N
Molecular Weight 449.244 g/mol
SMILES N1C(Oc2ccccc2C1=O)c1cc(I)c(c(c1)OCC)OCC#C
SPLASH splash10-00di-9720000000-885f0ca710d06fec5243
Source of Spectrum IY-2-5180-0
Synonyms 4H-1,3-Benzoxazin-4-one, 2-[3-ethoxy-5-iodo-4-(2-propynyloxy)phenyl]-2,3-dihydro- 2-(3-Ethoxy-5-iodo-4-prop-2-ynoxyphenyl)-2,3-dihydro-1,3-benzoxazin-4-one 2-(3-Ethoxy-5-iodo-4-prop-2-ynoxy-phenyl)-2,3-dihydro-1,3-benzoxazin-4-one 2-(3-Ethoxy-5-iodanyl-4-prop-2-ynoxy-phenyl)-2,3-dihydro-1,3-benzoxazin-4-one
Wiley ID 1659783