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Labd-14-ene 3.alpha.,8.alpha.,13.beta.-triol
SpectraBase Compound ID L7Wd8dbHA3m
InChI InChI=1S/C20H36O3/c1-7-18(4,22)10-8-16-19(5)13-14(21)12-17(2,3)15(19)9-11-20(16,6)23/h7,14-16,21-23H,1,8-13H2,2-6H3/t14-,15?,16?,18+,19?,20+/m0/s1
InChIKey KSGQYBWGWXFALJ-YDZRAEADSA-N
Mol Weight 324.5 g/mol
Molecular Formula C20H36O3
Exact Mass 324.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AaCCicrYBY7
Name Labd-14-ene 3.alpha.,8.alpha.,13.beta.-triol
CAS Registry Number 132796-58-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H36O3
InChI InChI=1S/C20H36O3/c1-7-18(4,22)10-8-16-19(5)13-14(21)12-17(2,3)15(19)9-11-20(16,6)23/h7,14-16,21-23H,1,8-13H2,2-6H3/t14-,15?,16?,18+,19?,20+/m0/s1
InChIKey KSGQYBWGWXFALJ-YDZRAEADSA-N
Molecular Weight 324.505 g/mol
SMILES O[C@]1(CC(C2C(C(CC[C@@](C=C)(O)C)[C@@](CC2)(O)C)(C1)C)(C)C)[H]
SPLASH splash10-057s-2910000000-a39f645515a906cee873
Source of Spectrum H-73-2162-8
Synonyms Labd-14-ene 2.alpha.,8.alpha.,13.beta.-triol (2R,7S)-1-[(3S)-3-hydroxy-3-methyl-4-pentenyl]-2,5,5,8a-tetramethyldecahydro-2,7-naphthalenediol
Wiley ID 1323565