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4-Formyl-1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrene
SpectraBase Compound ID GyAcwzwnULk
InChI InChI=1S/C20H28O/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4/h6,8,12-14,18H,5,7,9-11H2,1-4H3/t18?,19-,20+/m0/s1
InChIKey YCLCHPWRGSDZKL-NRRUETGQSA-N
Mol Weight 284.44 g/mol
Molecular Formula C20H28O
Exact Mass 284.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GoXRaI5qNjj
Name 4-Formyl-1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrene
Alternate Name(s) (1R,4aS)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxaldehyde (1R,4aS)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carbaldehyde
Comments Less than 3 mono-isotopic peaks
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Formula C20H28O
InChI InChI=1S/C20H28O/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4/h6,8,12-14,18H,5,7,9-11H2,1-4H3/t18?,19-,20+/m0/s1
InChIKey YCLCHPWRGSDZKL-NRRUETGQSA-N
Molecular Weight 284.443 g/mol
SMILES [C@]12(c3c(cc(cc3)C(C)C)CCC1[C@@](C=O)(C)CCC2)C
SPLASH splash10-0006-0090000000-aa1e9de58b5e57182273
Source of Spectrum SO-0-1058-1
Wiley ID 1539083