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Cannabicyclol
SpectraBase Compound ID 3ePf6l0XnsV
InChI InChI=1S/C21H30O2/c1-5-6-7-8-13-11-15(22)17-16(12-13)23-21(4)10-9-14-18(21)19(17)20(14,2)3/h11-12,14,18-19,22H,5-10H2,1-4H3/t14-,18+,19+,21+/m0/s1
InChIKey IGHTZQUIFGUJTG-QSMXQIJUSA-N
Mol Weight 314.47 g/mol
Molecular Formula C21H30O2
Exact Mass 314.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BlIOVYZKFHx
Name (.+/-.)-Cannabicyclol
Catalog Number 9002438
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O2
InChI InChI=1S/C21H30O2/c1-5-6-7-8-13-11-15(22)17-16(12-13)23-21(4)10-9-14-18(21)19(17)20(14,2)3/h11-12,14,18-19,22H,5-10H2,1-4H3/t14-,18+,19+,21+/m0/s1
InChIKey IGHTZQUIFGUJTG-QSMXQIJUSA-N
Molecular Weight 314.469 g/mol
SMILES Oc1c2c(cc(c1)CCCCC)O[C@]1([C@]3([C@@]2(C([C@]3(CC1)[H])(C)C)[H])[H])C
SPLASH splash10-001i-2390000000-4e6609a1ca3512193af6
Source of Spectrum CAY-2023-843-0
Wiley ID 1888801