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dimer of [3.2]metacyclophane-1-ene

View entire compound with spectra: 1 MS (GC)

dimer of [3.2]metacyclophane-1-ene
SpectraBase Compound ID 2NQQe82rgjX
InChI InChI=1S/2C17H16/c2*1-4-14-6-2-8-16(12-14)10-11-17-9-3-7-15(5-1)13-17/h2*1-4,6-9,12-13H,5,10-11H2/b2*4-1+
InChIKey JAQDCQQJEKGHEB-FIHNCOCPSA-N
Mol Weight 440.63 g/mol
Molecular Formula C34H32
Exact Mass 440.250401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3d2fyKAp0ID
Name dimer of [3.2]metacyclophane-1-ene
CAS Registry Number 121733-16-2
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H32
InChI InChI=1S/2C17H16/c2*1-4-14-6-2-8-16(12-14)10-11-17-9-3-7-15(5-1)13-17/h2*1-4,6-9,12-13H,5,10-11H2/b2*4-1+
InChIKey JAQDCQQJEKGHEB-FIHNCOCPSA-N
Molecular Weight 440.630 g/mol
SMILES c12\C=C\Cc3cc(CCc(c2)ccc1)ccc3.c12\C=C\Cc3cc(CCc(c2)ccc1)ccc3
SPLASH splash10-0006-1730900000-5784bb5770480a0313f1
Source of Spectrum K-122-2296-16
Synonyms bis((9E)-tricyclo[10.3.1.1(4,8)]heptadeca-1(16),4(17),5,7,9,12,14-heptaene)
Wiley ID 1384987