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1,4-Benzodioxin-5-carboxylic acid, 2,3-dihydro-8-[[4-methoxy-2-(phenylmethoxy)-6-propylbenzoyl]oxy]-6-propyl-, methyl ester
SpectraBase Compound ID 2H15RRZdhP8
InChI InChI=1S/C31H34O8/c1-5-10-21-16-23(34-3)18-24(38-19-20-12-8-7-9-13-20)26(21)31(33)39-25-17-22(11-6-2)27(30(32)35-4)29-28(25)36-14-15-37-29/h7-9,12-13,16-18H,5-6,10-11,14-15,19H2,1-4H3
InChIKey XUOSZQZBSFFJAR-UHFFFAOYSA-N
Mol Weight 534.6 g/mol
Molecular Formula C31H34O8
Exact Mass 534.225368 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2V4hgYPwmOH
Name 1,4-Benzodioxin-5-carboxylic acid, 2,3-dihydro-8-[[4-methoxy-2-(phenylmethoxy)-6-propylbenzoyl]oxy]-6-propyl-, methyl ester
CAS Registry Number 103142-23-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H34O8
InChI InChI=1S/C31H34O8/c1-5-10-21-16-23(34-3)18-24(38-19-20-12-8-7-9-13-20)26(21)31(33)39-25-17-22(11-6-2)27(30(32)35-4)29-28(25)36-14-15-37-29/h7-9,12-13,16-18H,5-6,10-11,14-15,19H2,1-4H3
InChIKey XUOSZQZBSFFJAR-UHFFFAOYSA-N
Molecular Weight 534.605 g/mol
SMILES c1(c2c(OCCO2)c(cc1CCC)OC(c1c(cc(cc1CCC)OC)OCc1ccccc1)=O)C(=O)OC
SPLASH splash10-001i-0090000000-93444f6e73d909d155ca
Source of Spectrum B-39-622-19
Synonyms Methyl 8-(2-benzyloxy-4-methoxy-6-propylbenzoyloxy)-6-propyl-2,3-dihydro-1,4-benzodioxine-5-carboxylate Methyl 8-{[2-(benzyloxy)-4-methoxy-6-propylbenzoyl]oxy}-6-propyl-2,3-dihydro-1,4-benzodioxin-5-carboxylate
Wiley ID 1403847