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Tetracyclo[14.2.2.1(4,8).1(9,13)]docosa-2,4,6,8(22),9,11,13(21),14,16,18, 19-undecaene
SpectraBase Compound ID Knm1U98BaUT
InChI InChI=1S/C22H16/c1-3-19-13-11-17-7-9-18(10-8-17)12-14-20-4-2-6-22(16-20)21(5-1)15-19/h1-16H/b13-11-,14-12-
InChIKey GJLHCRGDTQRNDA-XSYHWHKQSA-N
Mol Weight 280.37 g/mol
Molecular Formula C22H16
Exact Mass 280.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IY5RxhWCj6N
Name Tetracyclo[14.2.2.1(4,8).1(9,13)]docosa-2,4,6,8(22),9,11,13(21),14,16,18, 19-undecaene
Alternate Name(s) tetracyclo[14.2.2.1(4,8).1(9,13)]docosa-1(18),2,4(22),5,7,9(21),10,12,14,16,19-undecaene [2.2](3,3')-biphenyloparacyclophane-1,9-diene [2.2](3,3')biphenylparacyclophane-1,9-diene
CAS Registry Number 61983-93-5
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16
InChI InChI=1S/C22H16/c1-3-19-13-11-17-7-9-18(10-8-17)12-14-20-4-2-6-22(16-20)21(5-1)15-19/h1-16H/b13-11-,14-12-
InChIKey GJLHCRGDTQRNDA-XSYHWHKQSA-N
Molecular Weight 280.370 g/mol
SMILES c12-c3cc(\C=C/c4ccc(\C=C/c(c2)ccc1)cc4)ccc3
SPLASH splash10-0059-0090000000-441fa166302359a7c4a1
Source of Spectrum C-100-2461-0
Wiley ID 1284555