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delta-9-Tetrahydrocannabinol

View entire compound with spectra: 2 FTIR, and 11 MS (GC)

delta-9-Tetrahydrocannabinol
SpectraBase Compound ID Eg2WDGouzjL
InChI InChI=1S/C21H30O2/c1-5-6-7-8-15-12-18(22)20-16-11-14(2)9-10-17(16)21(3,4)23-19(20)13-15/h11-13,16-17,22H,5-10H2,1-4H3/t16-,17-/m1/s1
InChIKey CYQFCXCEBYINGO-IAGOWNOFSA-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 2rTxzifbge
Name (6aR,10aR)-3-amyl-6,6,9-trimethyl-6a,7,8,10a-tetrahydrobenzo[c]chromen-1-ol
Alternate Name(s) (6aR,10aR)-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydro-6H-benzo[c]chromen-1-ol (6aR,10aR)-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromen-1-ol (6aR,10aR)-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c][1]benzopyran-1-ol
CAS Registry Number 16849-50-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O2
InChI InChI=1S/C21H30O2/c1-5-6-7-8-15-12-18(22)20-16-11-14(2)9-10-17(16)21(3,4)23-19(20)13-15/h11-13,16-17,22H,5-10H2,1-4H3/t16-,17-/m1/s1
InChIKey CYQFCXCEBYINGO-IAGOWNOFSA-N
Molecular Weight 314.469 g/mol
SMILES Oc1c2[C@]3([C@](CCC(=C3)C)([H])C(Oc2cc(c1)CCCCC)(C)C)[H]
SPLASH splash10-01pn-3592000000-82f168c3e8340cfa0f4b
Source of Spectrum HE-1986-1546-0
Wiley ID 112240