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2-(hydroxymethyl)-3-phenyl-2,3-dihydro-1,4-benzodioxin-6-carboxaldehyde
SpectraBase Compound ID JwT77jbSYZA
InChI InChI=1S/C16H14O4/c17-9-11-6-7-13-14(8-11)20-16(15(10-18)19-13)12-4-2-1-3-5-12/h1-9,15-16,18H,10H2
InChIKey XXMQBXMVGIJIHA-UHFFFAOYSA-N
Mol Weight 270.28 g/mol
Molecular Formula C16H14O4
Exact Mass 270.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3G5Z9qF1WHD
Name 2-(hydroxymethyl)-3-phenyl-2,3-dihydro-1,4-benzodioxin-6-carboxaldehyde
Alternate Name(s) 2-(hydroxymethyl)-3-phenyl-2,3-dihydro-1,4-benzodioxine-6-carbaldehyde 2-Methylol-3-phenyl-2,3-dihydro-1,4-benzodioxin-6-carbaldehyde
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Formula C16H14O4
InChI InChI=1S/C16H14O4/c17-9-11-6-7-13-14(8-11)20-16(15(10-18)19-13)12-4-2-1-3-5-12/h1-9,15-16,18H,10H2
InChIKey XXMQBXMVGIJIHA-UHFFFAOYSA-N
Molecular Weight 270.284 g/mol
SMILES OCC1C(Oc2c(O1)ccc(c2)C=O)c1ccccc1
SPLASH splash10-00dm-4960000000-62bbd44b74ab5bd18773
Source of Spectrum SK-28-3124-5
Wiley ID 868635