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1-Benzoxepin-5(2H)-one, 3,7-bis[(acetyloxy)methyl]-
SpectraBase Compound ID Lcc5OCdgrdX
InChI InChI=1S/C16H16O6/c1-10(17)20-7-12-3-4-16-14(5-12)15(19)6-13(9-22-16)8-21-11(2)18/h3-6H,7-9H2,1-2H3
InChIKey BAEVZIBTHQYQRL-UHFFFAOYSA-N
Mol Weight 304.3 g/mol
Molecular Formula C16H16O6
Exact Mass 304.094688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D6vy4JlRIT
Name 1-Benzoxepin-5(2H)-one, 3,7-bis[(acetyloxy)methyl]-
Alternate Name(s) 3,7-bis(acetoxymethyl)benzoxepin-5(2H)-one {3-[(acetyloxy)methyl]-5-oxo-2,5-dihydro-1-benzoxepin-7-yl}methyl acetate
CAS Registry Number 60355-22-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16O6
InChI InChI=1S/C16H16O6/c1-10(17)20-7-12-3-4-16-14(5-12)15(19)6-13(9-22-16)8-21-11(2)18/h3-6H,7-9H2,1-2H3
InChIKey BAEVZIBTHQYQRL-UHFFFAOYSA-N
Molecular Weight 304.298 g/mol
SMILES c12C(C=C(COC(=O)C)COc2ccc(c1)COC(=O)C)=O
SPLASH splash10-0006-7291000000-dfc23e6e346cda0e358e
Source of Spectrum KC-1978-1492-0
Wiley ID 1306297