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11-Nor-delta-9-tetrahydrocannabinol carbocylic acid 2TMS

View entire compound with spectra: 4 MS (GC)

11-Nor-delta-9-tetrahydrocannabinol carbocylic acid 2TMS
SpectraBase Compound ID 1ERsxobZwRr
InChI InChI=1S/C27H44O4Si2/c1-10-11-12-13-19-16-23-25(24(17-19)30-32(4,5)6)21-18-20(26(28)31-33(7,8)9)14-15-22(21)27(2,3)29-23/h16-18,21-22H,10-15H2,1-9H3/t21-,22-/m1/s1
InChIKey RLALMBCUXILXIS-FGZHOGPDSA-N
Mol Weight 488.8 g/mol
Molecular Formula C27H44O4Si2
Exact Mass 488.277813 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DaHQzH9oXoI
Name TMS-11-COOH-tetrahydrocannabinol
Alternate Name(s) Trimethylsilyl (6aR,10aR)-6,6-dimethyl-3-pentyl-1-[(trimethylsilyl)oxy]-6a,7,8,10a-tetrahydro-6H-benzo[c]chromene-9-carboxylate Trimethylsilyl 1-trimethylsilyloxy-3-pentyl-6-oxa-7,7-dimethyltricyclo[8.4.0(8,13).0(5,14)]tetradeca-2,4,11,14(1)-tetraene-11-carboxylate
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Formula C27H44O4Si2
InChI InChI=1S/C27H44O4Si2/c1-10-11-12-13-19-16-23-25(24(17-19)30-32(4,5)6)21-18-20(26(28)31-33(7,8)9)14-15-22(21)27(2,3)29-23/h16-18,21-22H,10-15H2,1-9H3/t21-,22-/m1/s1
InChIKey RLALMBCUXILXIS-FGZHOGPDSA-N
Molecular Weight 488.815 g/mol
SMILES [C@@]12(c3c(cc(cc3O[Si](C)(C)C)CCCCC)OC([C@@]1(CCC(=C2)C(O[Si](C)(C)C)=O)[H])(C)C)[H]
SPLASH splash10-00di-0009800000-f00d2f7b96b53fb955d7
Source of Spectrum KO-15-119-2
Wiley ID 1396886