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10-Acetyl-3-hydroxy-8,9,10,10a-tetrahydro-6H-benzo[c]chromen-7(6aH)-one
SpectraBase Compound ID Dx5WWrS3rsx
InChI InChI=1S/C15H16O4/c1-8(16)10-4-5-13(18)12-7-19-14-6-9(17)2-3-11(14)15(10)12/h2-3,6,10,12,15,17H,4-5,7H2,1H3/t10-,12-,15+/m0/s1
InChIKey BRBLFMWZAVWBIB-ITDIGPHOSA-N
Mol Weight 260.29 g/mol
Molecular Formula C15H16O4
Exact Mass 260.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ca10e8IcJ0a
Name 10-Acetyl-3-hydroxy-8,9,10,10a-tetrahydro-6H-benzo[c]chromen-7(6aH)-one
Alternate Name(s) (6aS,10R,10aS)-10-acetyl-3-hydroxy-8,9,10,10a-tetrahydro-6H-benzo[c]chromen-7(6aH)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16O4
InChI InChI=1S/C15H16O4/c1-8(16)10-4-5-13(18)12-7-19-14-6-9(17)2-3-11(14)15(10)12/h2-3,6,10,12,15,17H,4-5,7H2,1H3/t10-,12-,15+/m0/s1
InChIKey BRBLFMWZAVWBIB-ITDIGPHOSA-N
Literature Reference DOI 10.1021/co200107s
Molecular Weight 260.289 g/mol
SMILES Oc1cc2c([C@]3([C@@](CCC([C@@]3(CO2)[H])=O)(C(=O)C)[H])[H])cc1
SPLASH splash10-0002-3890000000-37d037cd8a7d3019bb95
Source of Spectrum ACS-13-554/SM35-24{5,1}_Endo
Wiley ID 1754091