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[2.2]paracyclophane-4,15-[N',N"-1,2-diphenylcyclobutane-3,4-biscarbomide]
SpectraBase Compound ID AblRGM17rS1
InChI InChI=1S/C34H30N2O2/c37-33-31-29(25-7-3-1-4-8-25)30(26-9-5-2-6-10-26)32(31)34(38)36-28-20-22-12-11-21-13-15-23(27(19-21)35-33)17-18-24(28)16-14-22/h1-10,13-16,19-20,29-32H,11-12,17-18H2,(H,35,37)(H,36,38)/t29?,30?,31-,32?/m1/s1
InChIKey QSEQVQMLPGJSKT-BFZIBUCPSA-N
Mol Weight 498.6 g/mol
Molecular Formula C34H30N2O2
Exact Mass 498.230728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 59PvWdYOeWE
Name [2.2]paracyclophane-4,15-[N',N"-1,2-diphenylcyclobutane-3,4-biscarbomide]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H30N2O2
InChI InChI=1S/C34H30N2O2/c37-33-31-29(25-7-3-1-4-8-25)30(26-9-5-2-6-10-26)32(31)34(38)36-28-20-22-12-11-21-13-15-23(27(19-21)35-33)17-18-24(28)16-14-22/h1-10,13-16,19-20,29-32H,11-12,17-18H2,(H,35,37)(H,36,38)/t29?,30?,31-,32?/m1/s1
InChIKey QSEQVQMLPGJSKT-BFZIBUCPSA-N
Molecular Weight 498.626 g/mol
SMILES N1c2cc3ccc2CCc2c(NC([C@]4(C(C1=O)C(C4c1ccccc1)c1ccccc1)[H])=O)cc(CC3)cc2
SPLASH splash10-0fsj-1813900000-8b4a09198ea9fa4bf1ff
Source of Spectrum U2-2002-2305-28
Wiley ID 1522750