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1H-Naphtho[2,3-c]pyran-5,10-dione, 3,4-dihydro-9-hydroxy-1,3-dimethyl-7-(1-methylethoxy)-, trans-(.+-.)-
SpectraBase Compound ID 3iLiB0H0RbJ
InChI InChI=1S/C18H20O5/c1-8(2)22-11-6-13-16(14(19)7-11)18(21)15-10(4)23-9(3)5-12(15)17(13)20/h6-10,19H,5H2,1-4H3/t9-,10-/m0/s1
InChIKey PWBOOYNRRFTRTE-UWVGGRQHSA-N
Mol Weight 316.35 g/mol
Molecular Formula C18H20O5
Exact Mass 316.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IhTLyd5Duym
Name 1H-Naphtho[2,3-c]pyran-5,10-dione, 3,4-dihydro-9-hydroxy-1,3-dimethyl-7-(1-methylethoxy)-, trans-(.+-.)-
Alternate Name(s) (+-)-3,4-Dihydro-9-hydroxy-7-dsopropoxy-r-1,t-3-dimethyl-1H-naphtho[2,3-c]pyran-5,10-quinone (1S,3S)-9-hydroxy-7-isopropoxy-1,3-dimethyl-3,4-dihydro-1H-naphtho[2,3-c]pyran-5,10-dione
CAS Registry Number 119098-43-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O5
InChI InChI=1S/C18H20O5/c1-8(2)22-11-6-13-16(14(19)7-11)18(21)15-10(4)23-9(3)5-12(15)17(13)20/h6-10,19H,5H2,1-4H3/t9-,10-/m0/s1
InChIKey PWBOOYNRRFTRTE-UWVGGRQHSA-N
Molecular Weight 316.353 g/mol
SMILES Oc1c2C(C3=C(C(=O)c2cc(c1)OC(C)C)C[C@@](O[C@]3(C)[H])(C)[H])=O
SPLASH splash10-014i-0098000000-6ea64d438b018670751c
Source of Spectrum KC-1988-2473-5
Wiley ID 1316799