[3.3]orthocyclophane

SpectraBase Compound ID	JyWPgJ3V4ZM
InChI	InChI=1S/C18H20/c1-2-8-16-12-6-14-18-10-4-3-9-17(18)13-5-11-15(16)7-1/h1-4,7-10H,5-6,11-14H2
InChIKey	PWVAFAKRBIFUSG-UHFFFAOYSA-N Google Search
Mol Weight	236.36 g/mol
Molecular Formula	C18H20
Exact Mass	236.156501 g/mol

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SpectraBase Spectrum ID	LnFU3SAJ0lo
Name	[3.3]orthocyclophane
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C18H20
InChI	InChI=1S/C18H20/c1-2-8-16-12-6-14-18-10-4-3-9-17(18)13-5-11-15(16)7-1/h1-4,7-10H,5-6,11-14H2
InChIKey	PWVAFAKRBIFUSG-UHFFFAOYSA-N
Molecular Weight	236.358 g/mol
SMILES	c12c(CCCc3c(CCC2)cccc3)cccc1
SPLASH	splash10-000i-0090000000-958920459ade9f2c1282
Source of Spectrum	AJ-66-1241-1
Synonyms	5,6,7,12,13,14-hexahydrodibenzo[a,f]cyclodecene
Wiley ID	772050