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(1R*,4aS*,10S*,10aR*)-10-Hydroxy-7-methoxy-1-methyl-3,4,4a,9,10,10a-hexahydrophenanthren-2(1H)-one
SpectraBase Compound ID 7npLAfQCbaD
InChI InChI=1S/C16H20O3/c1-9-14(17)6-5-13-12-4-3-11(19-2)7-10(12)8-15(18)16(9)13/h3-4,7,9,13,15-16,18H,5-6,8H2,1-2H3/t9-,13+,15-,16-/m0/s1
InChIKey UCNZSZDLNVACJE-VCPCVOAUSA-N
Mol Weight 260.33 g/mol
Molecular Formula C16H20O3
Exact Mass 260.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KRi5lsQ5Vqj
Name (1R*,4aS*,10S*,10aR*)-10-Hydroxy-7-methoxy-1-methyl-3,4,4a,9,10,10a-hexahydrophenanthren-2(1H)-one
Alternate Name(s) (1R,4aS,10S,10aR)-10-hydroxy-7-methoxy-1-methyl-3,4,4a,9,10,10a-hexahydro-2(1H)-phenanthrenone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O3
InChI InChI=1S/C16H20O3/c1-9-14(17)6-5-13-12-4-3-11(19-2)7-10(12)8-15(18)16(9)13/h3-4,7,9,13,15-16,18H,5-6,8H2,1-2H3/t9-,13+,15-,16-/m0/s1
InChIKey UCNZSZDLNVACJE-VCPCVOAUSA-N
Molecular Weight 260.333 g/mol
SMILES O[C@@]1([C@@]2([C@@](c3c(C1)cc(cc3)OC)(CCC(=O)[C@@]2(C)[H])[H])[H])[H]
SPLASH splash10-0ir0-0930000000-545a8850ce45771b5e53
Source of Spectrum F-47-7962-4
Wiley ID 1264040