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[2H2]-(5.alpha.,9.alpha.,10.beta.,16.zeta.)-16-hydroxy-kauran-3-one
SpectraBase Compound ID FzI5a30tmfK
InChI InChI=1S/C20H32O2/c1-17(2)14-7-10-20-11-13(19(4,22)12-20)5-6-15(20)18(14,3)9-8-16(17)21/h13-15,22H,5-12H2,1-4H3/t13-,14+,15-,18+,19+,20+/m1/s1/i8D2
InChIKey BEHZKUOCCQYYJE-ADDIRYBTSA-N
Mol Weight 306.49 g/mol
Molecular Formula C20H302D2O2
Exact Mass 306.252784 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7mkDulm9jR8
Name [2H2]-(5.alpha.,9.alpha.,10.beta.,16.zeta.)-16-hydroxy-kauran-3-one
CAS Registry Number 76215-23-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30D2O2
InChI InChI=1S/C20H32O2/c1-17(2)14-7-10-20-11-13(19(4,22)12-20)5-6-15(20)18(14,3)9-8-16(17)21/h13-15,22H,5-12H2,1-4H3/t13-,14+,15-,18+,19+,20+/m1/s1/i8D2
InChIKey BEHZKUOCCQYYJE-ADDIRYBTSA-N
Molecular Weight 306.486 g/mol
SMILES O[C@]1(C[C@@]23[C@@]([C@@]4([C@](C(C)(C)C(C(C4)([2D])[2D])=O)(CC3)[H])C)(CC[C@@]1(C2)[H])[H])C
SPLASH splash10-0zg1-0091000000-bba7d411eb3431beb618
Source of Spectrum J-46-1097-0
Wiley ID 1306971