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(S,S)-2,5-Dibenzylcyclo[2.2.1]heptadiene
SpectraBase Compound ID BIEGPh5hsqz
InChI InChI=1S/C21H20/c1-3-7-16(8-4-1)11-18-13-21-15-20(18)14-19(21)12-17-9-5-2-6-10-17/h1-10,13-14,20-21H,11-12,15H2/t20-,21-/m1/s1
InChIKey NMAAYCBIZZGVPA-NHCUHLMSSA-N
Mol Weight 272.39 g/mol
Molecular Formula C21H20
Exact Mass 272.156501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1U36o2sRpUc
Name (S,S)-2,5-Dibenzylcyclo[2.2.1]heptadiene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20
InChI InChI=1S/C21H20/c1-3-7-16(8-4-1)11-18-13-21-15-20(18)14-19(21)12-17-9-5-2-6-10-17/h1-10,13-14,20-21H,11-12,15H2/t20-,21-/m1/s1
InChIKey NMAAYCBIZZGVPA-NHCUHLMSSA-N
Molecular Weight 272.391 g/mol
SMILES C1(=C[C@]2(C(Cc3ccccc3)=C[C@@]1(C2)[H])[H])Cc1ccccc1
SPLASH splash10-0006-9400000000-47e55a18c457d701ad4c
Source of Spectrum QC-21-542-4
Wiley ID 1688194