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trans-tetrahydrocannabidiol
SpectraBase Compound ID CZjbsWSbuMg
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+/m1/s1
InChIKey LXIXAVCVBZBXIY-KVJCIMDZSA-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 DDYyweYGOMZ
Name trans-tetrahydrocannabidiol
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+/m1/s1
InChIKey LXIXAVCVBZBXIY-KVJCIMDZSA-N
Instrument Name Thermo Scientific DSQII
Ionization Type EI
Literature Reference DOI 10.1021/acs.jnatprod.1c00567
Molecular Weight 318.501 g/mol
SMILES Oc1c(c(cc(c1)CCCCC)O)[C@@]1([C@](CCC(C1)C)(C(C)C)[H])[H]
SPLASH splash10-000x-1941000000-bbc17694afa5dbd226e8
Sample Comments Trans isomer
Source of Spectrum G4-84-SM25-7, trans-THD
Wiley ID 1884114