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(1S,4aS,9S)-1,4a-dimethyl-9-oxidanyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carbaldehyde
SpectraBase Compound ID GYWQ4rm3XFg
InChI InChI=1S/C20H28O2/c1-13(2)14-6-7-16-15(10-14)17(22)11-18-19(3,12-21)8-5-9-20(16,18)4/h6-7,10,12-13,17-18,22H,5,8-9,11H2,1-4H3/t17-,18?,19+,20+/m0/s1
InChIKey XQQXJHFHNIHWNU-LTLCQPOLSA-N
Mol Weight 300.44 g/mol
Molecular Formula C20H28O2
Exact Mass 300.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9eAyUoBfLop
Name (1S,4aS,9S)-1,4a-dimethyl-9-oxidanyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carbaldehyde
Alternate Name(s) (1S,4aS,9S)-9-hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carbaldehyde (1S,4aS,9S)-9-hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxaldehyde (1S,4aS,9S)-9-hydroxy-7-isopropyl-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carbaldehyde
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Formula C20H28O2
InChI InChI=1S/C20H28O2/c1-13(2)14-6-7-16-15(10-14)17(22)11-18-19(3,12-21)8-5-9-20(16,18)4/h6-7,10,12-13,17-18,22H,5,8-9,11H2,1-4H3/t17-,18?,19+,20+/m0/s1
InChIKey XQQXJHFHNIHWNU-LTLCQPOLSA-N
Molecular Weight 300.442 g/mol
SMILES O[C@]1(CC2[C@@](c3c1cc(cc3)C(C)C)(CCC[C@@]2(C=O)C)C)[H]
SPLASH splash10-001i-9212000000-140a737df6532aeffef4
Source of Spectrum G4-64-513-4
Wiley ID 1608930