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(4aS*,6aR*,11bR*)-6,6-Dimethyl-1,2,3,4,4a,6,6a,11b-octahydroindeno[1,2-c]chromene
SpectraBase Compound ID ExhA1R73Dot
InChI InChI=1S/C18H22O/c1-18(2)17-13-8-4-3-7-12(13)11-15(17)14-9-5-6-10-16(14)19-18/h3-4,7-8,11,14,16-17H,5-6,9-10H2,1-2H3/t14-,16+,17+/m1/s1
InChIKey HQVYEHMGKQOLAF-PVAVHDDUSA-N
Mol Weight 254.37 g/mol
Molecular Formula C18H22O
Exact Mass 254.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9SmGQzya6YU
Name (4aS*,6aR*,11bR*)-6,6-Dimethyl-1,2,3,4,4a,6,6a,11b-octahydroindeno[1,2-c]chromene
Appearance White solid
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Exact Mass 254.167065327 u
Formula C18H22O
GC Column HP-5MS
InChI InChI=1S/C18H22O/c1-18(2)17-13-8-4-3-7-12(13)11-15(17)14-9-5-6-10-16(14)19-18/h3-4,7-8,11,14,16-17H,5-6,9-10H2,1-2H3/t14-,16+,17+/m1/s1
InChIKey HQVYEHMGKQOLAF-PVAVHDDUSA-N
Instrument Name Agilent 6890N-5973
Ionization Type EI
Literature Reference DOI 10.1002/chem.201405789
Molecular Weight 254.373 g/mol
Quality 39
Reported Formula C18H22O
SMILES C1([C@@]2(C([C@]3(CCCC[C@@]3(O1)[H])[H])=CC=1C=CC=CC21)[H])(C)C
SPLASH splash10-002b-0910000000-08b1213994a397c61bae
Sample Comments dr = ~1.3:1
Source of Spectrum QE-21-SM32-15e maj (DOI: 10.1002/chem.201405789)
Wiley ID 1907688