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(1r(*),2r(*),3r(*),6s(*),7r(*),9r(*),10s(*),11z,14r(*))-6-acetoxyeunicella-11-ene-3,7-diol
SpectraBase Compound ID JrZ94PpG5J7
InChI InChI=1S/C22H36O5/c1-12(2)15-8-7-13(3)18-16-11-22(6,25)17(26-14(4)23)9-10-21(5,24)20(27-16)19(15)18/h7,12,15-20,24-25H,8-11H2,1-6H3
InChIKey QTCWWOOKJDGITI-UHFFFAOYSA-N
Mol Weight 380.5 g/mol
Molecular Formula C22H36O5
Exact Mass 380.256274 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BuXXat1fkgZ
Name (1r(*),2r(*),3r(*),6s(*),7r(*),9r(*),10s(*),11z,14r(*))-6-acetoxyeunicella-11-ene-3,7-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H36O5
InChI InChI=1S/C22H36O5/c1-12(2)15-8-7-13(3)18-16-11-22(6,25)17(26-14(4)23)9-10-21(5,24)20(27-16)19(15)18/h7,12,15-20,24-25H,8-11H2,1-6H3
InChIKey QTCWWOOKJDGITI-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 380.525 g/mol
SMILES OC1(CC2C3C(C(C(CCC1OC(C)=O)(C)O)O2)C(CC=C3C)C(C)C)C
SPLASH splash10-0006-7910000000-a3fbecb8e8c72e0e1915
Source of Spectrum SRH-2022-10671-0
Wiley ID 1832283