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(2E)-6-methoxy-2-(2-methylbenzylidene)coumaran-3-one
SpectraBase Compound ID 3d3X5zoVgHt
InChI InChI=1S/C17H14O3/c1-11-5-3-4-6-12(11)9-16-17(18)14-8-7-13(19-2)10-15(14)20-16/h3-10H,1-2H3/b16-9+
InChIKey XKZIXQXQVDIDCC-CXUHLZMHSA-N
Mol Weight 266.3 g/mol
Molecular Formula C17H14O3
Exact Mass 266.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 41p8VSBD3A
Name (2E)-6-methoxy-2-(2-methylbenzylidene)coumaran-3-one
CAS Registry Number 77764-85-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14O3
InChI InChI=1S/C17H14O3/c1-11-5-3-4-6-12(11)9-16-17(18)14-8-7-13(19-2)10-15(14)20-16/h3-10H,1-2H3/b16-9+
InChIKey XKZIXQXQVDIDCC-CXUHLZMHSA-N
Molecular Weight 266.296 g/mol
SMILES C1(\C(Oc2cc(ccc12)OC)=C/c1c(C)cccc1)=O
SPLASH splash10-0gb9-0690000000-35a1fcc3ec87e89d0e63
Source of Spectrum O-15-554-4
Synonyms (2E)-6-methoxy-2-(o-tolylmethylene)benzofuran-3-one (2E)-6-methoxy-2-[(2-methylphenyl)methylidene]-1-benzofuran-3-one (2E)-6-methoxy-2-[(2-methylphenyl)methylidene]-3-benzofuranone
Wiley ID 1270449