For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Benzoic acid, 2,2'-(2,4-di-2-naphthalenyl-1,3-cyclobutanediyl)bis-, dimethyl ester, (1.alpha.,2.beta.,3.alpha.,4.beta.)-
SpectraBase Compound ID ADATnf6TXsW
InChI InChI=1S/C40H32O4/c1-43-39(41)33-17-9-7-15-31(33)37-35(29-21-19-25-11-3-5-13-27(25)23-29)38(32-16-8-10-18-34(32)40(42)44-2)36(37)30-22-20-26-12-4-6-14-28(26)24-30/h3-24,35-38H,1-2H3
InChIKey WTQSFRBRFBQSNV-UHFFFAOYSA-N
Mol Weight 576.7 g/mol
Molecular Formula C40H32O4
Exact Mass 576.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6i2JZ8RAcEC
Name Benzoic acid, 2,2'-(2,4-di-2-naphthalenyl-1,3-cyclobutanediyl)bis-, dimethyl ester, (1.alpha.,2.beta.,3.alpha.,4.beta.)-
CAS Registry Number 90340-77-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H32O4
InChI InChI=1S/C40H32O4/c1-43-39(41)33-17-9-7-15-31(33)37-35(29-21-19-25-11-3-5-13-27(25)23-29)38(32-16-8-10-18-34(32)40(42)44-2)36(37)30-22-20-26-12-4-6-14-28(26)24-30/h3-24,35-38H,1-2H3
InChIKey WTQSFRBRFBQSNV-UHFFFAOYSA-N
Molecular Weight 576.692 g/mol
SMILES C1(C(c2cc3ccccc3cc2)C(C1c1cc2ccccc2cc1)c1c(C(=O)OC)cccc1)c1c(C(=O)OC)cccc1
SPLASH splash10-000i-0090000000-c28a7f11e5607df8366a
Source of Spectrum B-37-574-0
Synonyms Dimethyl 2,2'-[t-2,t-4-di(naphthalen-2-yl)cyclobutane-r-1,c-3-diyl]dibenzoate Methyl 2-[3-[2-(methoxycarbonyl)phenyl]-2,4-di(2-naphthyl)cyclobutyl]benzoate
Wiley ID 1408274