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(1S,2E,2R,4aS,10aR)-1-allyl-7-methoxy-2-methyl-3,4,4a,9,10,10a-hexahydro-1H-phenanthrene-2-carbaldehyde oxime
SpectraBase Compound ID Ikm0G3U221n
InChI InChI=1S/C20H27NO2/c1-4-5-19-18-8-6-14-12-15(23-3)7-9-16(14)17(18)10-11-20(19,2)13-21-22/h4,7,9,12-13,17-19,22H,1,5-6,8,10-11H2,2-3H3/b21-13+/t17-,18-,19+,20+/m1/s1
InChIKey VAACQCPKCJAJIH-AGZZZXSSSA-N
Mol Weight 313.44 g/mol
Molecular Formula C20H27NO2
Exact Mass 313.204179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L3Ca6Z31gnS
Name (1S,2E,2R,4aS,10aR)-1-allyl-7-methoxy-2-methyl-3,4,4a,9,10,10a-hexahydro-1H-phenanthrene-2-carbaldehyde oxime
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Formula C20H27NO2
InChI InChI=1S/C20H27NO2/c1-4-5-19-18-8-6-14-12-15(23-3)7-9-16(14)17(18)10-11-20(19,2)13-21-22/h4,7,9,12-13,17-19,22H,1,5-6,8,10-11H2,2-3H3/b21-13+/t17-,18-,19+,20+/m1/s1
InChIKey VAACQCPKCJAJIH-AGZZZXSSSA-N
Instrument Name Varian MAT 311A
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0011.b10
Molecular Weight 313.441 g/mol
SMILES O\N=C\[C@@]1(CC[C@@]2(c3ccc(cc3CC[C@]2([C@@]1(CC=C)[H])[H])OC)[H])C
SPLASH splash10-022a-9848000000-dfe775dc4ed7f0af0aec
Source of Spectrum ARK-2010-107-2
Thin-Layer Chromatography Rf = 0.19 (dichloromethane)
Wiley ID 1869945