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1,4-Di(tricyclo[4.1.0.0(2,7)]hept-1-yl)benene
SpectraBase Compound ID JoPN9Od7xtP
InChI InChI=1S/C20H22/c1-3-13-17-14(4-1)19(13,17)11-7-9-12(10-8-11)20-15-5-2-6-16(20)18(15)20/h7-10,13-18H,1-6H2/t13-,14-,15+,16+,17-,18-,19+,20+
InChIKey JMTUPKUJPNDFJX-NIKAVIDOSA-N
Mol Weight 262.4 g/mol
Molecular Formula C20H22
Exact Mass 262.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 88iYlGEgxOu
Name 1,4-Di(tricyclo[4.1.0.0(2,7)]hept-1-yl)benene
CAS Registry Number 126978-55-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22
InChI InChI=1S/C20H22/c1-3-13-17-14(4-1)19(13,17)11-7-9-12(10-8-11)20-15-5-2-6-16(20)18(15)20/h7-10,13-18H,1-6H2/t13-,14-,15+,16+,17-,18-,19+,20+
InChIKey JMTUPKUJPNDFJX-NIKAVIDOSA-N
Molecular Weight 262.396 g/mol
SMILES [C@]12([C@@]3([C@@]2(CCC[C@]13[H])[H])[H])c1ccc([C@]23[C@]4([C@]3(CCC[C@@]24[H])[H])[H])cc1
SPLASH splash10-0fvl-6900000000-6a616f7b69381a9eaa86
Source of Spectrum K-123-1499-6
Synonyms 1-(4-tricyclo[4.1.0.0(2,7)]hept-1-ylphenyl)tricyclo[4.1.0.0(2,7)]heptane
Wiley ID 1266570