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.delta.8-iso-THC
SpectraBase Compound ID 4JVSewoj3Hm
InChI InChI=1S/C21H30O2/c1-5-6-7-8-15-11-18(22)20-17-13-21(4,23-19(20)12-15)10-9-16(17)14(2)3/h11-12,16-17,22H,2,5-10,13H2,1,3-4H3/t16-,17+,21+/m0/s1
InChIKey NUXUDGMVYZUFNQ-CSODHUTKSA-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 8Iv0mBZziCt
Name .delta.8-iso-THC
Catalog Number 37613
Lot Number 682397
CAS Registry Number 23050-47-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O2
InChI InChI=1S/C21H30O2/c1-5-6-7-8-15-11-18(22)20-17-13-21(4,23-19(20)12-15)10-9-16(17)14(2)3/h11-12,16-17,22H,2,5-10,13H2,1,3-4H3/t16-,17+,21+/m0/s1
InChIKey NUXUDGMVYZUFNQ-CSODHUTKSA-N
Quality 993
SMILES OC1=C2[C@]3([C@@](CC[C@](C3)(OC2=CC(CCCCC)=C1)C)(C(C)=C)[H])[H]
SPLASH splash10-001i-1591000000-40c635283b2f2037f893
Source of Spectrum CAY-2024-2235-0
Synonyms (2R,5R,6R)-2-methyl-9-pentyl-5-(prop-1-en-2-yl)-3,4,5,6-tetrahydro-2H-2,6-methanobenzo[b]oxocin-7-ol (1R,9R,12R)-9-methyl-5-pentyl-12-(prop-1-en-2-yl)-8-oxatricyclo[7.3.1.0(2,7)]trideca-2,4,6-trien-3-ol
Wiley ID 1890556