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1-Acetoxy-8,9-(isopropylidenedioxy)-10-oxo-1(R*),4,4a(S*),9(R*),9a(R*),10-hexahyroanthracene
SpectraBase Compound ID 6aVln87dUBo
InChI InChI=1S/C19H20O5/c1-10(20)22-13-8-4-6-11-15(13)18-16-12(17(11)21)7-5-9-14(16)23-19(2,3)24-18/h4-5,7-9,11,13,15,18H,6H2,1-3H3/t11-,13+,15+,18+/m0/s1
InChIKey KONDIQVKBWXNLR-HMECXNKFSA-N
Mol Weight 328.36 g/mol
Molecular Formula C19H20O5
Exact Mass 328.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 55ORPYm5bgr
Name 1-Acetoxy-8,9-(isopropylidenedioxy)-10-oxo-1(R*),4,4a(S*),9(R*),9a(R*),10-hexahyroanthracene
Alternate Name(s) (7aS,11R,11aR,11bR)-2,2-dimethyl-7-oxo-7,7a,8,11,11a,11b-hexahydroanthra[1,9-de][1,3]dioxin-11-yl acetate
CAS Registry Number 73794-51-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20O5
InChI InChI=1S/C19H20O5/c1-10(20)22-13-8-4-6-11-15(13)18-16-12(17(11)21)7-5-9-14(16)23-19(2,3)24-18/h4-5,7-9,11,13,15,18H,6H2,1-3H3/t11-,13+,15+,18+/m0/s1
InChIKey KONDIQVKBWXNLR-HMECXNKFSA-N
Molecular Weight 328.364 g/mol
SMILES c12[C@]3([C@]4([C@](OC(=O)C)(C=CC[C@@]4(C(c2cccc1OC(C)(C)O3)=O)[H])[H])[H])[H]
SPLASH splash10-03fr-0590000000-b1ec2a2546828ee46979
Source of Spectrum J-48-3259-0
Wiley ID 1326340