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Benzyl 2'-O-Methylhyperlatolate

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Benzyl 2'-O-Methylhyperlatolate
SpectraBase Compound ID 8UJC2gTOCNu
InChI InChI=1S/C35H44O7/c1-5-7-9-10-15-19-27-21-29(23-31(40-4)33(27)34(37)41-24-25-16-13-11-14-17-25)42-35(38)32-26(18-12-8-6-2)20-28(39-3)22-30(32)36/h11,13-14,16-17,20-23,36H,5-10,12,15,18-19,24H2,1-4H3
InChIKey GVDKUVDXDSLELF-UHFFFAOYSA-N
Mol Weight 576.7 g/mol
Molecular Formula C35H44O7
Exact Mass 576.308704 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bw3HdAwuZ0P
Name Benzyl 2'-O-Methylhyperlatolate
Alternate Name(s) 4-[(benzyloxy)carbonyl]-3-heptyl-5-methoxyphenyl 2-hydroxy-4-methoxy-6-pentylbenzoate Benzyl 2-heptyl-4-(2'-hydroxy-4'-methoxy-6'-pentylbenzoyloxy)-6-methoxybenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H44O7
InChI InChI=1S/C35H44O7/c1-5-7-9-10-15-19-27-21-29(23-31(40-4)33(27)34(37)41-24-25-16-13-11-14-17-25)42-35(38)32-26(18-12-8-6-2)20-28(39-3)22-30(32)36/h11,13-14,16-17,20-23,36H,5-10,12,15,18-19,24H2,1-4H3
InChIKey GVDKUVDXDSLELF-UHFFFAOYSA-N
Molecular Weight 576.730 g/mol
SMILES Oc1c(C(Oc2cc(OC)c(c(c2)CCCCCCC)C(OCc2ccccc2)=O)=O)c(cc(OC)c1)CCCCC
SPLASH splash10-0006-9010000000-6c8b898b9b47d41d5fae
Source of Spectrum B-44-1645-12
Wiley ID 1408247