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Jungermannenone C
SpectraBase Compound ID Lboa2PMSMt5
InChI InChI=1S/C20H28O2/c1-11-13-10-12-6-7-14-19(2,3)8-5-9-20(14,4)16(12)15(17(11)21)18(13)22/h13-15,18,22H,1,5-10H2,2-4H3/t13-,14-,15+,18+,20-/m1/s1
InChIKey FQDAEGYLRVQRKN-KZWXMACTSA-N
Mol Weight 300.44 g/mol
Molecular Formula C20H28O2
Exact Mass 300.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0yO5Wh7oZ6
Name Jungermannenone C
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O2
InChI InChI=1S/C20H28O2/c1-11-13-10-12-6-7-14-19(2,3)8-5-9-20(14,4)16(12)15(17(11)21)18(13)22/h13-15,18,22H,1,5-10H2,2-4H3/t13-,14-,15+,18+,20-/m1/s1
InChIKey FQDAEGYLRVQRKN-KZWXMACTSA-N
Molecular Weight 300.442 g/mol
SMILES O[C@@]1([C@]2(C=3[C@]4([C@](C(C)(C)CCC4)([H])CCC3C[C@@]1(C(C2=O)=C)[H])C)[H])[H]
SPLASH splash10-0uy0-4986000000-94f212ebd8d4d9b55674
Source of Spectrum KC-61-4541-7
Wiley ID 1629092