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(3aR*,5S*,9bR*)-6,9-Dimethoxy-5-propyl-3,3a,5,9b-tetrahydro-2H-furo[3,2-c]isochromen-2-one
SpectraBase Compound ID A1FLQHmNI8S
InChI InChI=1S/C16H20O5/c1-4-5-11-14-9(18-2)6-7-10(19-3)15(14)16-12(20-11)8-13(17)21-16/h6-7,11-12,16H,4-5,8H2,1-3H3/t11-,12+,16-/m0/s1
InChIKey JJCXJOJZSSQYSV-OZVIIMIRSA-N
Mol Weight 292.33 g/mol
Molecular Formula C16H20O5
Exact Mass 292.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5oRBHg4BnEW
Name (3aR*,5S*,9bR*)-6,9-Dimethoxy-5-propyl-3,3a,5,9b-tetrahydro-2H-furo[3,2-c]isochromen-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O5
InChI InChI=1S/C16H20O5/c1-4-5-11-14-9(18-2)6-7-10(19-3)15(14)16-12(20-11)8-13(17)21-16/h6-7,11-12,16H,4-5,8H2,1-3H3/t11-,12+,16-/m0/s1
InChIKey JJCXJOJZSSQYSV-OZVIIMIRSA-N
Molecular Weight 292.331 g/mol
SMILES c12[C@@]3([C@](CC(O3)=O)([H])O[C@](c1c(OC)ccc2OC)(CCC)[H])[H]
SPLASH splash10-0002-0090000000-84e3ed520c182deefc82
Source of Spectrum F4-42-420-19
Synonyms (3aR,5S,9bR)-6,9-dimethoxy-5-propyl-3,3a,5,9b-tetrahydrofuro[3,2-c][2]benzopyran-2-one (3aR,5S,9bR)-6,9-dimethoxy-5-propyl-3,3a,5,9b-tetrahydrofuro[3,2-c]isochromen-2-one
Wiley ID 1673637