[2.2.2.2.2]paracyclophane

SpectraBase Compound ID	7L7QQ3R1BbN
InChI	InChI=1S/C40H40/c1-2-39-28-26-37-22-18-35(19-23-37)16-14-33-10-6-31(7-11-33)4-5-32-8-12-34(13-9-32)15-17-36-20-24-38(25-21-36)27-29-40(3-1)30-39/h1-3,6-13,18-25,30H,4-5,14-17,26-29H2
InChIKey	LSZAXLFJSSBXKL-UHFFFAOYSA-N Google Search
Mol Weight	520.8 g/mol
Molecular Formula	C40H40
Exact Mass	520.313001 g/mol

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SpectraBase Spectrum ID	AfQXhxN7GoY
Name	[2.2.2.2.2]paracyclophane
CAS Registry Number	43082-13-9
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C40H40
InChI	InChI=1S/C40H40/c1-2-39-28-26-37-22-18-35(19-23-37)16-14-33-10-6-31(7-11-33)4-5-32-8-12-34(13-9-32)15-17-36-20-24-38(25-21-36)27-29-40(3-1)30-39/h1-3,6-13,18-25,30H,4-5,14-17,26-29H2
InChIKey	LSZAXLFJSSBXKL-UHFFFAOYSA-N
Molecular Weight	520.760 g/mol
SMILES	c12ccc(cc2)CCc2ccc(cc2)CCc2cc(CCc3ccc(CCc4ccc(CC1)cc4)cc3)ccc2
SPLASH	splash10-0zmi-2950050000-346469e49c43c181a117
Source of Spectrum	K-121-1344-0
Synonyms	Hexacyclo[27.2.2.2(4,7).2(10,13).2(16,19).1(22,26)]tetraconta-1(31),4,6,10,12,16,18,22(40),23,25,29,32,34,36,38-pentadecaene
Wiley ID	1402081