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5-Methoxy-7-(acetoxymethyl)-8-(hydroxycarbonyl)-2-(1'-pentenyl)-2,3-dihydrobenzopyran-4(4H)-one

View entire compound with spectra: 1 MS (GC)

5-Methoxy-7-(acetoxymethyl)-8-(hydroxycarbonyl)-2-(1'-pentenyl)-2,3-dihydrobenzopyran-4(4H)-one
SpectraBase Compound ID 9CsEa4i24MN
InChI InChI=1S/C19H22O7/c1-4-5-6-7-13-9-14(21)17-15(24-3)8-12(10-25-11(2)20)16(19(22)23)18(17)26-13/h6-8,13H,4-5,9-10H2,1-3H3,(H,22,23)/b7-6+
InChIKey FZGSQGMTEOPVMA-VOTSOKGWSA-N
Mol Weight 362.38 g/mol
Molecular Formula C19H22O7
Exact Mass 362.136553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9SizLgqJcNk
Name 5-Methoxy-7-(acetoxymethyl)-8-(hydroxycarbonyl)-2-(1'-pentenyl)-2,3-dihydrobenzopyran-4(4H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O7
InChI InChI=1S/C19H22O7/c1-4-5-6-7-13-9-14(21)17-15(24-3)8-12(10-25-11(2)20)16(19(22)23)18(17)26-13/h6-8,13H,4-5,9-10H2,1-3H3,(H,22,23)/b7-6+
InChIKey FZGSQGMTEOPVMA-VOTSOKGWSA-N
Molecular Weight 362.378 g/mol
SMILES OC(c1c2c(C(CC(\C=C\CCC)O2)=O)c(cc1COC(=O)C)OC)=O
SPLASH splash10-0adi-0091000000-751363643a87d85d9482
Source of Spectrum X2-48-922-10
Synonyms 15-O-acetyl-cavoxone 5-Methoxy-7-(acetoxymethyl)-8-(hydroxycarbonyl)-2-(2'-pentenyl)-2,3-dihydrobenzopyran-4(4H)-one 7-[(acetyloxy)methyl]-5-methoxy-4-oxo-2-[(1E)-1-pentenyl]-8-chromanecarboxylic acid
Wiley ID 1601745