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(10aR)-8-chloranyl-5,6-dimethoxy-2,9,10,10a-tetrahydro-1H-phenanthren-3-one
SpectraBase Compound ID 6D2Hq9fxUMq
InChI InChI=1S/C16H17ClO3/c1-19-14-8-13(17)11-6-4-9-3-5-10(18)7-12(9)15(11)16(14)20-2/h7-9H,3-6H2,1-2H3/t9-/m0/s1
InChIKey POCIADINJFTAHF-VIFPVBQESA-N
Mol Weight 292.76 g/mol
Molecular Formula C16H17ClO3
Exact Mass 292.086622 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CTsFAMijTQr
Name (10aR)-8-chloranyl-5,6-dimethoxy-2,9,10,10a-tetrahydro-1H-phenanthren-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17ClO3
InChI InChI=1S/C16H17ClO3/c1-19-14-8-13(17)11-6-4-9-3-5-10(18)7-12(9)15(11)16(14)20-2/h7-9H,3-6H2,1-2H3/t9-/m0/s1
InChIKey POCIADINJFTAHF-VIFPVBQESA-N
Molecular Weight 292.762 g/mol
SMILES C1=2c3c(c(Cl)cc(c3OC)OC)CC[C@@]1(CCC(C2)=O)[H]
SPLASH splash10-0006-0090000000-98e2839147bb05db7e6c
Source of Spectrum J-63-5915-23
Synonyms (10aR)-8-chloro-5,6-dimethoxy-2,9,10,10a-tetrahydro-1H-phenanthren-3-one
Wiley ID 1295331