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4-N-(2'-methoxycarbonylphenyl)amino[2.2]paracyclophane
SpectraBase Compound ID AwDUShOUIsG
InChI InChI=1S/C24H23NO2/c1-27-24(26)21-4-2-3-5-22(21)25-23-16-19-11-10-17-6-8-18(9-7-17)12-14-20(23)15-13-19/h2-9,13,15-16,25H,10-12,14H2,1H3
InChIKey MAYQLTJWXMENEI-UHFFFAOYSA-N
Mol Weight 357.45 g/mol
Molecular Formula C24H23NO2
Exact Mass 357.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3xjQQVcOxCq
Name 4-N-(2'-methoxycarbonylphenyl)amino[2.2]paracyclophane
Alternate Name(s) Methyl 2-(1,4(1,4)-dibenzenacyclohexaphane-1(2)-ylamino)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H23NO2
InChI InChI=1S/C24H23NO2/c1-27-24(26)21-4-2-3-5-22(21)25-23-16-19-11-10-17-6-8-18(9-7-17)12-14-20(23)15-13-19/h2-9,13,15-16,25H,10-12,14H2,1H3
InChIKey MAYQLTJWXMENEI-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ijch.201100070
Molecular Weight 357.453 g/mol
SMILES N(c1c2ccc(c1)CCc1ccc(cc1)CC2)c1c(cccc1)C(=O)OC
SPLASH splash10-0k96-1943000000-695c4b6963674d1fa90e
Source of Spectrum TI-52-176-5g
Wiley ID 1806674