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1-Acetoxy-8,9-(isopropylidenedioxy)-10-oxo-1(R*),4,4a(S*),9(R*),9a(R*),10-hexahyroanthracene

View entire compound with spectra: 1 NMR, and 1 MS (GC)

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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2EtVRwpeyU7
Name 1-Acetoxy-8,9-(isopropylidenedioxy)-10-oxo-1(R*),4,4A(S*),9(R*),9A(R*),10-hexahyroanthracene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 328.131073739 u
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 C1=2[C@]3([C@]4([C@](OC(=O)C)(C=CC[C@@]4(C(C2C=CC=C1OC(C)(C)O3)=O)[H])[H])[H])[H]