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1-Hydroxy-6,6-dimethyl-3-pentyl-6a,7,10,10a-tetrahydro-6H-dibenzo[b,d]pyran-9-carbaldehyde

HCID 124158
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Basic information

CAS
53865-18-2
Standard SMILES
CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CC=C(C=O)C[C@@H]21
InChIKey
BGIBNWZALWRTHR-IAGOWNOFSA-N
Molecular formula
C21H28O3
Average molar mass
328.452 g/mol
Monoisotopic mass
328.20384476

Names & identifiers

Preferred name
1-Hydroxy-6,6-dimethyl-3-pentyl-6a,7,10,10a-tetrahydro-6H-dibenzo[b,d]pyran-9-carbaldehyde
IUPAC
(6aR,10aR)-1-Hydroxy-6,6-dimethyl-3-pentyl-6a,7,10,10a-tetrahydro-6H-dibenzo[b,d]pyran-9-carbaldehyde
English name
11-oxo-delta(8)-tetrahydrocannabinol
Molecular formula
C21H28O3
Molecular weight
328.45

Names & synonyms

11-oxo-delta(8)-tetrahydrocannabinol6H-Dibenzo[b,d]pyran-9-carboxaldehyde, 6a,7,10,10a-tetrahydro-1-hydroxy-6,6-dimethyl-3-pentyl-, (6aR,10aR)-

Database identifiers

CAS
53865-18-2
PubChem CID
124158
DTXSID
DTXSID20968638
Nikkaji
J415.694C

Properties

Physicochemical properties

Boiling point
423.7 · 423.7±45.0 °C(Predicted)
Density
1.108 · 1.108±0.06 g/cm3(Predicted)
pka
9.75 · 9.75±0.60(Predicted)

Related reactions

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Compound notes

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