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(1RS,3aRS,4SR,7aRS)-4,7a-Dimethyl-3a-(3-methylbut-2-en-1-yl)octahydro-1H-1,4-methanoinden-1-ol
SpectraBase Compound ID LGi8LKGwF2w
InChI InChI=1S/C17H28O/c1-13(2)6-9-16-10-11-17(18)12-14(16,3)7-5-8-15(16,17)4/h6,18H,5,7-12H2,1-4H3/t14-,15-,16+,17+/m1/s1
InChIKey VUHFJNIPODQGDJ-NCOADZHNSA-N
Mol Weight 248.41 g/mol
Molecular Formula C17H28O
Exact Mass 248.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2YlxUndlxyF
Name (1RS,3aRS,4SR,7aRS)-4,7a-Dimethyl-3a-(3-methylbut-2-en-1-yl)octahydro-1H-1,4-methanoinden-1-ol
Appearance Yellowish oil
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Exact Mass 248.214015521 u
Formula C17H28O
InChI InChI=1S/C17H28O/c1-13(2)6-9-16-10-11-17(18)12-14(16,3)7-5-8-15(16,17)4/h6,18H,5,7-12H2,1-4H3/t14-,15-,16+,17+/m1/s1
InChIKey VUHFJNIPODQGDJ-NCOADZHNSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201709659
Molecular Weight 248.410 g/mol
Quality 121
SMILES O[C@@]12[C@@]3(CCC[C@@]([C@]3(CC=C(C)C)CC1)(C2)C)C
SPLASH splash10-001i-3900000000-b1d41b30174cc6949922
Source of Spectrum ACI-57-SM8-6 (DOI: 10.1002/anie.201709659)
Thin-Layer Chromatography 0.50 (hexane/EtOAc, 4:1)
Wiley ID 1890606