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Trogopteroid D
SpectraBase Compound ID FPML6JiQhfi
InChI InChI=1S/C20H28O3/c1-12(2)18-13-5-8-16-19(3,14(13)6-7-15(18)22)10-9-17(23)20(16,4)11-21/h6-7,12,16,21-22H,5,8-11H2,1-4H3/t16?,19-,20-/m1/s1
InChIKey ZMXPSMLBSFAIOY-ODFWGIBRSA-N
Mol Weight 316.44 g/mol
Molecular Formula C20H28O3
Exact Mass 316.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HCMowMrzCFz
Name Trogopteroid D
Appearance White powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O3
InChI InChI=1S/C20H28O3/c1-12(2)18-13-5-8-16-19(3,14(13)6-7-15(18)22)10-9-17(23)20(16,4)11-21/h6-7,12,16,21-22H,5,8-11H2,1-4H3/t16?,19-,20-/m1/s1
InChIKey ZMXPSMLBSFAIOY-ODFWGIBRSA-N
Instrument Name Finnigan-4510
Ionization Type EI
Literature Reference DOI 10.1021/np900814s
Molecular Weight 316.441 g/mol
Optical Rotation [a]D24 = +17.4 (c = 0.12, MeOH)
Reported Formula C20H28O3
SMILES OC[C@]1(C(CC[C@@]2(c3ccc(c(c3CCC12)C(C)C)O)C)=O)C
SPLASH splash10-00dj-1392000000-07fb7806049690ed0f1f
Source of Spectrum G4-73-868-4
Wiley ID 1846444