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(6aR,10aR)-10.beta.-Hydroxy-.delta.8-tetrahydrocannabinol
SpectraBase Compound ID HhaICB3zVes
InChI InChI=1S/C21H30O3/c1-5-6-7-8-14-11-16(22)19-17(12-14)24-21(3,4)15-10-9-13(2)20(23)18(15)19/h9,11-12,15,18,20,22-23H,5-8,10H2,1-4H3/t15-,18-,20-/m1/s1
InChIKey KQQMZTULVOWZJR-XFQXTVEOSA-N
Mol Weight 330.47 g/mol
Molecular Formula C21H30O3
Exact Mass 330.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Vyc0yQFM0
Name (6aR,10aR)-10.beta.-Hydroxy-.delta.8-tetrahydrocannabinol
Appearance Yellow oil
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Formula C21H30O3
InChI InChI=1S/C21H30O3/c1-5-6-7-8-14-11-16(22)19-17(12-14)24-21(3,4)15-10-9-13(2)20(23)18(15)19/h9,11-12,15,18,20,22-23H,5-8,10H2,1-4H3/t15-,18-,20-/m1/s1
InChIKey KQQMZTULVOWZJR-XFQXTVEOSA-N
Instrument Name HP 6890-5973 GC
Ionization Type EI
Literature Reference DOI 10.1021/acs.jnatprod.5b00065
Optical Rotation [a]D25 = -78.7 (c = 0.59, CHCl3)
Reported Formula C21H30O3
SMILES Oc1cc(cc2c1[C@]1([C@@](CC=C([C@]1(O)[H])C)(C(O2)(C)C)[H])[H])CCCCC
SPLASH splash10-03dj-0093000000-944c3fa739ea65f703cd
Source of Spectrum G4-78-1275-4
Wiley ID 1865868