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Benzene, 1-[8-(2,3-dimethoxyphenyl)-1-heptyloctyl]-3,4-dimethoxy-2-pentadecyl-
SpectraBase Compound ID GpChsdKpN30
InChI InChI=1S/C46H78O4/c1-7-9-11-13-14-15-16-17-18-19-20-25-29-35-42-41(37-38-44(48-4)46(42)50-6)39(31-26-22-12-10-8-2)32-27-23-21-24-28-33-40-34-30-36-43(47-3)45(40)49-5/h30,34,36-39H,7-29,31-33,35H2,1-6H3
InChIKey VMFMKIAIWQZEEX-UHFFFAOYSA-N
Mol Weight 695.1 g/mol
Molecular Formula C46H78O4
Exact Mass 694.590011 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9qZ4L0mqEhx
Name Benzene, 1-[8-(2,3-dimethoxyphenyl)-1-heptyloctyl]-3,4-dimethoxy-2-pentadecyl-
CAS Registry Number 97072-79-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C46H78O4
InChI InChI=1S/C46H78O4/c1-7-9-11-13-14-15-16-17-18-19-20-25-29-35-42-41(37-38-44(48-4)46(42)50-6)39(31-26-22-12-10-8-2)32-27-23-21-24-28-33-40-34-30-36-43(47-3)45(40)49-5/h30,34,36-39H,7-29,31-33,35H2,1-6H3
InChIKey VMFMKIAIWQZEEX-UHFFFAOYSA-N
Molecular Weight 695.126 g/mol
SMILES c1(c(ccc(c1OC)OC)C(CCCCCCC)CCCCCCCc1c(c(OC)ccc1)OC)CCCCCCCCCCCCCCC
SPLASH splash10-0gb9-0900000000-0242f4e85d1d67e00af1
Source of Spectrum J-50-2621-13
Synonyms 1-[8-(2,3-dimethoxyphenyl)-1-heptyloctyl]-3,4-dimethoxy-2-pentadecylbenzene 3-[8-(3,4-dimethoxy-2-pentadecylphenyl)pentadecyl]veratrole
Wiley ID 1414894