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TMS-3'-OH,11-COOH-tetrahydrocannabinol
SpectraBase Compound ID 6hZV7nSsZLq
InChI InChI=1S/C30H52O5Si3/c1-13-23(33-36(4,5)6)16-14-21-18-26-28(27(19-21)34-37(7,8)9)24-20-22(29(31)35-38(10,11)12)15-17-25(24)30(2,3)32-26/h18-20,23-25H,13-17H2,1-12H3/t23?,24-,25+/m1/s1
InChIKey DGXPOJIILSDGEQ-ZQWZXOJDSA-N
Mol Weight 577.0 g/mol
Molecular Formula C30H52O5Si3
Exact Mass 576.312254 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GCYkgBFKhcI
Name TMS-3'-OH,11-COOH-tetrahydrocannabinol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H52O5Si3
InChI InChI=1S/C30H52O5Si3/c1-13-23(33-36(4,5)6)16-14-21-18-26-28(27(19-21)34-37(7,8)9)24-20-22(29(31)35-38(10,11)12)15-17-25(24)30(2,3)32-26/h18-20,23-25H,13-17H2,1-12H3/t23?,24-,25+/m1/s1
InChIKey DGXPOJIILSDGEQ-ZQWZXOJDSA-N
Molecular Weight 576.996 g/mol
SMILES [C@@]12(c3c(cc(cc3O[Si](C)(C)C)CCC(O[Si](C)(C)C)CC)OC([C@]1(CCC(=C2)C(O[Si](C)(C)C)=O)[H])(C)C)[H]
SPLASH splash10-001i-0000920000-25d731167abaa3712e41
Source of Spectrum KO-15-119-2
Synonyms Trimethylsilyl 1-trimethylsilyloxy-3-[.gamma.-(trimethylsilyloxyoxy)pentyl]-6-oxa-7,7-dimethyltricyclo[8.4.0(8,13).0(5,14)]tetradeca-2,4,11,14(1)-tetraene-11-carboxylate Trimethylsilyl 6,6-dimethyl-1-[(trimethylsilyl)oxy]-3-{3-[(trimethylsilyl)oxy]pentyl}-6a,7,8,10a-tetrahydro-6H-benzo[c]chromene-9-carboxylate
Wiley ID 1408198