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Companulin
SpectraBase Compound ID Jf5QpXZiEnc
InChI InChI=1S/C30H50O/c1-24(2)13-14-26(5)15-16-27(6)21-10-9-20-25(3,4)23-11-12-30(20,31-23)29(21,8)18-17-28(27,7)22(26)19-24/h20-23H,9-19H2,1-8H3/t20-,21+,22+,23-,26+,27+,28-,29+,30+/m0/s1
InChIKey KSXPPAGQQYHJFU-UUMPUPCCSA-N
Mol Weight 426.7 g/mol
Molecular Formula C30H50O
Exact Mass 426.386166 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IVLLIHKahrJ
Name Companulin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H50O
InChI InChI=1S/C30H50O/c1-24(2)13-14-26(5)15-16-27(6)21-10-9-20-25(3,4)23-11-12-30(20,31-23)29(21,8)18-17-28(27,7)22(26)19-24/h20-23H,9-19H2,1-8H3/t20-,21+,22+,23-,26+,27+,28-,29+,30+/m0/s1
InChIKey KSXPPAGQQYHJFU-UUMPUPCCSA-N
Molecular Weight 426.729 g/mol
SMILES [C@]123[C@]4([C@]([C@]5(CC[C@@]6([C@]([C@@]5(CC4)C)(CC(CC6)(C)C)[H])C)C)([H])CC[C@]3(C(C)(C)[C@@](O1)(CC2)[H])[H])C
SPLASH splash10-0c2c-9710200000-3ee80f5f5b989108d451
Source of Spectrum CD-466-0-0
Synonyms (1R,2R,5S,6R,11R,14R,15R,18S,20S)-2,5,8,8,11,14,19,19-octamethyl-23-oxahexacyclo[18.2.1.0(1,18).0(2,15).0(5,14).0(6,11)]tricosane Dendropanoxide Epoxyglutinane
Wiley ID 1380235