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5-(3-Hydroxypropyl])-5'-[1,3-dihydroxy-2-(2-hydroxyphenoxy)propyl]-2,2'-dihydroxybiphenyl peracetate
SpectraBase Compound ID 1uSv7dF0ztc
InChI InChI=1S/C36H38O13/c1-21(37)43-17-9-10-27-13-15-31(45-23(3)39)29(18-27)30-19-28(14-16-32(30)46-24(4)40)36(48-26(6)42)35(20-44-22(2)38)49-34-12-8-7-11-33(34)47-25(5)41/h7-8,11-16,18-19,35-36H,9-10,17,20H2,1-6H3
InChIKey POXPWMXDKLENDK-UHFFFAOYSA-N
Mol Weight 678.7 g/mol
Molecular Formula C36H38O13
Exact Mass 678.231241 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F9uJMvaM6ug
Name 5-(3-Hydroxypropyl])-5'-[1,3-dihydroxy-2-(2-hydroxyphenoxy)propyl]-2,2'-dihydroxybiphenyl peracetate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H38O13
InChI InChI=1S/C36H38O13/c1-21(37)43-17-9-10-27-13-15-31(45-23(3)39)29(18-27)30-19-28(14-16-32(30)46-24(4)40)36(48-26(6)42)35(20-44-22(2)38)49-34-12-8-7-11-33(34)47-25(5)41/h7-8,11-16,18-19,35-36H,9-10,17,20H2,1-6H3
InChIKey POXPWMXDKLENDK-UHFFFAOYSA-N
Molecular Weight 678.687 g/mol
SMILES c1(-c2c(OC(=O)C)ccc(c2)CCCOC(=O)C)cc(C(C(Oc2c(OC(=O)C)cccc2)COC(=O)C)OC(=O)C)ccc1OC(=O)C
SPLASH splash10-0pdr-0096518000-f2aefce57f0d06d61730
Source of Spectrum KC-0-3428-8
Wiley ID 826886