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1-Dibenzofuranol, 5a,8,9,9a-tetrahydro-6-methyl-9-(1-methylethenyl)-3-pentyl-, [5aS-(5a.alpha.,9.alpha.,9a.alpha.)]-
SpectraBase Compound ID 2GI8F2xiNJS
InChI InChI=1S/C21H28O2/c1-5-6-7-8-15-11-17(22)20-18(12-15)23-21-14(4)9-10-16(13(2)3)19(20)21/h9,11-12,16,19,21-22H,2,5-8,10H2,1,3-4H3/t16-,19+,21+/m0/s1
InChIKey YPQLZKKAWUFMFC-LDQXTDLNSA-N
Mol Weight 312.45 g/mol
Molecular Formula C21H28O2
Exact Mass 312.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GbnKle9bKJx
Name 1-Dibenzofuranol, 5a,8,9,9a-tetrahydro-6-methyl-9-(1-methylethenyl)-3-pentyl-, [5aS-(5a.alpha.,9.alpha.,9a.alpha.)]-
Alternate Name(s) (5aS,9R,9aR)-9-isopropenyl-6-methyl-3-pentyl-5a,8,9,9a-tetrahydrodibenzo[b,d]furan-1-ol Anhydrocannabielsoin
CAS Registry Number 54490-23-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28O2
InChI InChI=1S/C21H28O2/c1-5-6-7-8-15-11-17(22)20-18(12-15)23-21-14(4)9-10-16(13(2)3)19(20)21/h9,11-12,16,19,21-22H,2,5-8,10H2,1,3-4H3/t16-,19+,21+/m0/s1
InChIKey YPQLZKKAWUFMFC-LDQXTDLNSA-N
Molecular Weight 312.453 g/mol
SMILES Oc1c2[C@@]3([C@](Oc2cc(CCCCC)c1)(C(=CC[C@]3(C(=C)C)[H])C)[H])[H]
SPLASH splash10-0a4i-0192000000-89efc20d30bb8e675156
Source of Spectrum KC-1976-14-0
Wiley ID 1313878