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Secotridentochinon-diacetate
SpectraBase Compound ID 66pXOeHhNxT
InChI InChI=1S/C30H40O7/c1-18-10-8-12-19(2)14-16-23-26(33)29(37-22(5)32)25(27(34)28(23)36-21(4)31)24(30(6,7)35)17-15-20(3)13-9-11-18/h10,13-14,24,35H,8-9,11-12,15-17H2,1-7H3/b18-10+,19-14+,20-13+/t24-/m0/s1
InChIKey QBLOUDNPKMPKMG-LBTHKVRTSA-N
Mol Weight 512.6 g/mol
Molecular Formula C30H40O7
Exact Mass 512.277404 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8dzpyG9wCQv
Name Secotridentochinon-diacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H40O7
InChI InChI=1S/C30H40O7/c1-18-10-8-12-19(2)14-16-23-26(33)29(37-22(5)32)25(27(34)28(23)36-21(4)31)24(30(6,7)35)17-15-20(3)13-9-11-18/h10,13-14,24,35H,8-9,11-12,15-17H2,1-7H3/b18-10+,19-14+,20-13+/t24-/m0/s1
InChIKey QBLOUDNPKMPKMG-LBTHKVRTSA-N
Molecular Weight 512.643 g/mol
SMILES OC([C@]1(CC\C(=C\CC\C(=C\CC\C(=C\CC2=C(C(C1=C(C2=O)OC(C)=O)=O)OC(C)=O)C)C)C)[H])(C)C
SPLASH splash10-0229-0008910000-4b49243e3cb939b48e0b
Source of Spectrum K-108-3691-6b
Synonyms (S,1E,3E,7E,11E)-15-(2-hydroxypropan-2-yl)-4,8,12-trimethyl-18,20-dioxobicyclo[14.2.2]icosa-1(19),3,7,11,16-pentaene-17,19-diyl diacetate
Wiley ID 1793845