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benzyl 2,2'-di-O-methyldivaricatate
SpectraBase Compound ID ITnDBraCbzA
InChI InChI=1S/C30H34O7/c1-6-11-21-15-23(33-3)17-25(34-4)28(21)30(32)37-24-16-22(12-7-2)27(26(18-24)35-5)29(31)36-19-20-13-9-8-10-14-20/h8-10,13-18H,6-7,11-12,19H2,1-5H3
InChIKey VWBNUGCMISLSRZ-UHFFFAOYSA-N
Mol Weight 506.6 g/mol
Molecular Formula C30H34O7
Exact Mass 506.230453 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 45gNxw6BNGj
Name benzyl 2,2'-di-O-methyldivaricatate
Comments Less than 3 mono-isotopic peaks
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Formula C30H34O7
InChI InChI=1S/C30H34O7/c1-6-11-21-15-23(33-3)17-25(34-4)28(21)30(32)37-24-16-22(12-7-2)27(26(18-24)35-5)29(31)36-19-20-13-9-8-10-14-20/h8-10,13-18H,6-7,11-12,19H2,1-5H3
InChIKey VWBNUGCMISLSRZ-UHFFFAOYSA-N
Molecular Weight 506.595 g/mol
SMILES c1(C(Oc2cc(OC)c(c(c2)CCC)C(OCc2ccccc2)=O)=O)c(cc(cc1CCC)OC)OC
SPLASH splash10-0a4i-3090000000-156e9f6e3102bb638b46
Source of Spectrum B-46-301-0
Synonyms 4-[(benzyloxy)carbonyl]-3-methoxy-5-propylphenyl 2,4-dimethoxy-6-propylbenzoate
Wiley ID 1399905