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sublobaric acid
SpectraBase Compound ID K19WSdxk3nF
InChI InChI=1S/C23H24O8/c1-4-6-7-8-13-19(22(26)27)16(25)11-18-21(13)30-17-10-12(29-3)9-14(15(24)5-2)20(17)23(28)31-18/h9-11,25H,4-8H2,1-3H3,(H,26,27)
InChIKey CJICVZBHNINYQF-UHFFFAOYSA-N
Mol Weight 428.44 g/mol
Molecular Formula C23H24O8
Exact Mass 428.147118 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ERrtbnC9ZMG
Name sublobaric acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H24O8
InChI InChI=1S/C23H24O8/c1-4-6-7-8-13-19(22(26)27)16(25)11-18-21(13)30-17-10-12(29-3)9-14(15(24)5-2)20(17)23(28)31-18/h9-11,25H,4-8H2,1-3H3,(H,26,27)
InChIKey CJICVZBHNINYQF-UHFFFAOYSA-N
Molecular Weight 428.437 g/mol
SMILES Oc1cc2OC(c3c(Oc2c(c1C(=O)O)CCCCC)cc(cc3C(=O)CC)OC)=O
SPLASH splash10-004i-0246900000-773105e17a9a6fc8dcbb
Source of Spectrum JA-50-763-0
Synonyms 8-Hydroxy-3-methoxy-11-oxo-6-pentyl-1-propionyl-11H-dibenzo[b,e][1,4]dioxepin-7-carboxylic acid
Wiley ID 1380681