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HU-308

View entire compound with spectra: 3 MS (GC)

HU-308
SpectraBase Compound ID 3uMWJ0XIfWL
InChI InChI=1S/C27H42O3/c1-8-9-10-11-12-26(2,3)19-14-23(29-6)25(24(15-19)30-7)20-13-18(17-28)21-16-22(20)27(21,4)5/h13-15,20-22,28H,8-12,16-17H2,1-7H3/t20-,21+,22-/m0/s1
InChIKey CFMRIVODIXTERW-BDTNDASRSA-N
Mol Weight 414.6 g/mol
Molecular Formula C27H42O3
Exact Mass 414.313395 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9vB3NbpPVQb
Name HU-308
Alternate Name(s) [(1R,2R,5R)-2-[2,6-dimethoxy-4-(2-methyloctan-2-yl)phenyl]-7,7-dimethyl-4-bicyclo[3.1.1]hept-3-enyl] methanol ((1S,4S,5S)-4-(2,6-dimethoxy-4-(2-methyloctan-2-yl)phenyl)-6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl)methanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H42O3
InChI InChI=1S/C27H42O3/c1-8-9-10-11-12-26(2,3)19-14-23(29-6)25(24(15-19)30-7)20-13-18(17-28)21-16-22(20)27(21,4)5/h13-15,20-22,28H,8-12,16-17H2,1-7H3/t20-,21+,22-/m0/s1
InChIKey CFMRIVODIXTERW-BDTNDASRSA-N
Molecular Weight 414.630 g/mol
SMILES OCC1=C[C@@]([C@]2(C([C@@]1(C2)[H])(C)C)[H])(c1c(cc(cc1OC)C(CCCCCC)(C)C)OC)[H]
SPLASH splash10-0i29-2689000000-cad7233573a85fbb1f81
Source of Spectrum SWG-33-1203-0
Wiley ID 1809069