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19-Norkaur-16-ene-15-carboxaldehyde, 3-oxo-, (4.beta.,15.alpha.)-
SpectraBase Compound ID BOxYf934LnD
InChI InChI=1S/C20H28O2/c1-12-14-4-5-18-19(3)8-7-17(22)13(2)15(19)6-9-20(18,10-14)16(12)11-21/h11,13-16,18H,1,4-10H2,2-3H3/t13-,14-,15+,16-,18-,19+,20-/m1/s1
InChIKey NPCLKNHAJPVFTC-DVIXLVCNSA-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 ARAOd8lssU5
Name 19-Norkaur-16-ene-15-carboxaldehyde, 3-oxo-, (4.beta.,15.alpha.)-
Alternate Name(s) (1S,4S,5R,9S,10R,13R,15R)-5,9-dimethyl-14-methylene-6-oxotetracyclo[11.2.1.0(1,10).0(4,9)]hexadecane-15-carbaldehyde 1H-2,10a-ethanophenanthrene, 19-norkaur-16-ene-15-carboxaldehyde deriv. 3-oxo 15-carbaldehyde
CAS Registry Number 76844-14-9
Comments Less than 3 mono-isotopic peaks
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Formula C20H28O2
InChI InChI=1S/C20H28O2/c1-12-14-4-5-18-19(3)8-7-17(22)13(2)15(19)6-9-20(18,10-14)16(12)11-21/h11,13-16,18H,1,4-10H2,2-3H3/t13-,14-,15+,16-,18-,19+,20-/m1/s1
InChIKey NPCLKNHAJPVFTC-DVIXLVCNSA-N
Molecular Weight 300.442 g/mol
SMILES [C@]123[C@@]([C@]4(CCC([C@@]([C@@]4(CC3)[H])(C)[H])=O)C)(CC[C@](C2)(C([C@]1(C=O)[H])=C)[H])[H]
SPLASH splash10-0f89-0096000000-679c8a680e4f3f2d2484
Source of Spectrum B-33-2067-0
Wiley ID 1303337