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Sandaracopimarinol
SpectraBase Compound ID KcHnwmAJnrz
InChI InChI=1S/C20H32O/c1-5-18(2)12-9-16-15(13-18)7-8-17-19(3,14-21)10-6-11-20(16,17)4/h5,13,16-17,21H,1,6-12,14H2,2-4H3/t16-,17-,18-,19-,20+/m0/s1
InChIKey JEOZUAHPKAVXSF-VYJAJWGXSA-N
Mol Weight 288.5 g/mol
Molecular Formula C20H32O
Exact Mass 288.245316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CFtwHfjwRki
Name ((1R,4aR,4bS,7R,10aR)-1,4a,7-Trimethyl-7-vinyl-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydrophenanthren-1-yl)methanol
Carrier Gas Helium (54.1 mL/min)
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Exact Mass 288.245315649 u
Formula C20H32O
GC Column SH-Rxi-5silMS (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 250oC
InChI InChI=1S/C20H32O/c1-5-18(2)12-9-16-15(13-18)7-8-17-19(3,14-21)10-6-11-20(16,17)4/h5,13,16-17,21H,1,6-12,14H2,2-4H3/t16-,17-,18-,19-,20+/m0/s1
InChIKey JEOZUAHPKAVXSF-VYJAJWGXSA-N
Inlet Type Split ratio (50:05)
Instrument Name Shimadzu TQ8050 plus
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.202300332
Molecular Weight 288.475 g/mol
Quality 824
SMILES OC[C@]1([C@]2([C@](CCC1)([C@@]1(C(CC2)=C[C@@](CC1)(C)C=C)[H])C)[H])C
SPLASH splash10-0a4i-6940000000-1ddcbc65b70b39b87288
Source of Spectrum CBD-20-SM12-12-2 (DOI: 10.1002/cbdv.202300332)
Wiley ID 1909902