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(1S-(1.alpha.,2.beta.,4a.beta.,4b.alpha.,8a.beta.,10a.alpha.))-Tetradecahydro-3-hydroxy-2,4b,8,8,10a-pentamethyl-1-phenanthremethanol
SpectraBase Compound ID 7nEpRYFALkh
InChI InChI=1S/C20H36O2/c1-13-14(12-21)19(4)10-7-16-18(2,3)8-6-9-20(16,5)17(19)11-15(13)22/h13-17,21-22H,6-12H2,1-5H3/t13-,14-,15?,16+,17+,19+,20+/m0/s1
InChIKey NHDDUSKWBSUFSV-MLSLTSBTSA-N
Mol Weight 308.5 g/mol
Molecular Formula C20H36O2
Exact Mass 308.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HBtIuW2qWXW
Name (1S-(1.alpha.,2.beta.,4a.beta.,4b.alpha.,8a.beta.,10a.alpha.))-Tetradecahydro-3-hydroxy-2,4b,8,8,10a-pentamethyl-1-phenanthremethanol
Alternate Name(s) copalane-diol Tetradecahydro-3- hydroxy-2,4b,8,8,10a-pentamethyl-1-phenanthrene-methanol [(5beta,8alpha,9beta,10alpha,13beta,14alpha)-12-hydroxy-8,13-dimethylpodocarpan-14-yl]methanol
CAS Registry Number 72264-57-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H36O2
InChI InChI=1S/C20H36O2/c1-13-14(12-21)19(4)10-7-16-18(2,3)8-6-9-20(16,5)17(19)11-15(13)22/h13-17,21-22H,6-12H2,1-5H3/t13-,14-,15?,16+,17+,19+,20+/m0/s1
InChIKey NHDDUSKWBSUFSV-MLSLTSBTSA-N
Molecular Weight 308.506 g/mol
SMILES OC[C@]1([C@@](C(C[C@@]2([C@@]1(CC[C@@]1(C(CCC[C@@]21C)(C)C)[H])C)[H])O)(C)[H])[H]
SPLASH splash10-05fv-2900000000-76c7bce27e7aae7d8cdc
Source of Spectrum J-45-514-0
Wiley ID 1310275