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4-N-(3'-Methylphenyl)amino[2.2]paracyclophane
SpectraBase Compound ID Cbkl2Jmy3Un
InChI InChI=1S/C23H23N/c1-17-3-2-4-22(15-17)24-23-16-20-10-9-18-5-7-19(8-6-18)11-13-21(23)14-12-20/h2-8,12,14-16,24H,9-11,13H2,1H3
InChIKey QLIGIMXRYVZMLE-UHFFFAOYSA-N
Mol Weight 313.44 g/mol
Molecular Formula C23H23N
Exact Mass 313.18305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5y8UgemA4nZ
Name 4-N-(3'-Methylphenyl)amino[2.2]paracyclophane
Alternate Name(s) N-(m-tolyl)-1,4(1,4)-dibenzenacyclohexaphan-1(2)-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H23N
InChI InChI=1S/C23H23N/c1-17-3-2-4-22(15-17)24-23-16-20-10-9-18-5-7-19(8-6-18)11-13-21(23)14-12-20/h2-8,12,14-16,24H,9-11,13H2,1H3
InChIKey QLIGIMXRYVZMLE-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ijch.201100070
Molecular Weight 313.444 g/mol
SMILES N(c1c2ccc(c1)CCc1ccc(cc1)CC2)c1cc(ccc1)C
SPLASH splash10-08fr-1369000000-7b6c2a255c8b7fcfccae
Source of Spectrum TI-52-176-5f
Wiley ID 1806673