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Tetrahydrocannabidiol

View entire compound with spectra: 1 MS (GC)

Tetrahydrocannabidiol
SpectraBase Compound ID Bezu9pIzjCv
InChI InChI=1S/C21H34O2/c1-5-6-7-8-16-12-19(22)21(20(23)13-16)18-11-15(4)9-10-17(18)14(2)3/h12-15,17-18,22-23H,5-11H2,1-4H3/t15?,17-,18?/m0/s1
InChIKey LXIXAVCVBZBXIY-NXYGQSRBSA-N
Mol Weight 318.5 g/mol
Molecular Formula C21H34O2
Exact Mass 318.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BgKCAOOc2ON
Name Tetrahydrocannabidiol
Alternate Name(s) 2-[(2S)-5-methyl-2-propan-2-ylcyclohexyl]-5-pentylbenzene-1,3-diol 2-[(2S)-2-isopropyl-5-methyl-cyclohexyl]-5-pentyl-benzene-1,3-diol 2-[(2S)-5-methyl-2-propan-2-yl-cyclohexyl]-5-pentyl-benzene-1,3-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34O2
InChI InChI=1S/C21H34O2/c1-5-6-7-8-16-12-19(22)21(20(23)13-16)18-11-15(4)9-10-17(18)14(2)3/h12-15,17-18,22-23H,5-11H2,1-4H3/t15?,17-,18?/m0/s1
InChIKey LXIXAVCVBZBXIY-NXYGQSRBSA-N
Molecular Weight 318.501 g/mol
SMILES Oc1c(c(cc(c1)CCCCC)O)C1[C@@](CCC(C1)C)(C(C)C)[H]
SPLASH splash10-00l6-0895000000-676451632ac998c06f21
Source of Spectrum AF-49-1115-7
Wiley ID 1694240