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Hexocannabitriol
SpectraBase Compound ID AQswpckFWnm
InChI InChI=1S/C21H30O3/c1-5-6-7-8-15-11-17(22)20(18(23)12-15)19-16(13(2)3)10-9-14(4)21(19)24/h11-12,16,19,21-24H,2,4-10H2,1,3H3/t16-,19+,21-/m0/s1
InChIKey YVEPGCZIBQXPJW-SCWSEQNSSA-N
Mol Weight 330.47 g/mol
Molecular Formula C21H30O3
Exact Mass 330.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GvZtD8sgN8Y
Name Hexocannabitriol
Catalog Number 36829
Lot Number 646326
CAS Registry Number 380495-68-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 330.219494823 u
Formula C21H30O3
InChI InChI=1S/C21H30O3/c1-5-6-7-8-15-11-17(22)20(18(23)12-15)19-16(13(2)3)10-9-14(4)21(19)24/h11-12,16,19,21-24H,2,4-10H2,1,3H3/t16-,19+,21-/m0/s1
InChIKey YVEPGCZIBQXPJW-SCWSEQNSSA-N
Molecular Weight 330.468 g/mol
Purity >=98%
Quality 993
SMILES OC1=C([C@@]2([C@](C(CC[C@]2(C(C)=C)[H])=C)(O)[H])[H])C(=CC(=C1)CCCCC)O
SPLASH splash10-0006-2971000000-82cb89815b05b8e1741f
Source of Spectrum CAY-2024-2259-0
Synonyms 2(R)-hydroxy-.delta.7-Cannabidiol 2(R)-hydroxy-.delta.7-CBD 2-((1R,2R,6R)-2-hydroxy-3-methylene-6-(prop-1-en-2-yl)cyclohexyl)-5-pentylbenzene-1,3-diol 2-[(1R,2R,6R)-2-hydroxy-3-methylidene-6-(prop-1-en-2-yl)cyclohexyl]-5-pentylbenzene-1,3-diol
Wiley ID 1890444