Isoxazolo[4'',5'':3',4']cyclobuta[1',2':3,4]cyclobut[1,2-d]isoxazole, 3a,3b,3c,6a,6b,6c-hexahydro-3,4-bis(2,4,6-trimethylphenyl)-, (3a.alpha.,3b.beta.,3c.alpha.,6a.alpha.,6b.beta., 6c.alpha.)-

SpectraBase Compound ID	LJczlXBaMdi
InChI	InChI=1S/C26H28N2O2/c1-11-7-13(3)17(14(4)8-11)23-21-19-20(25(21)29-27-23)22-24(28-30-26(19)22)18-15(5)9-12(2)10-16(18)6/h7-10,19-22,25-26H,1-6H3
InChIKey	NSCHIGGJVBCIJB-UHFFFAOYSA-N Google Search
Mol Weight	400.52 g/mol
Molecular Formula	C26H28N2O2
Exact Mass	400.215078 g/mol

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SpectraBase Spectrum ID	4uC6N0CUCe
Name	Isoxazolo[4'',5'':3',4']cyclobuta[1',2':3,4]cyclobut[1,2-d]isoxazole, 3a,3b,3c,6a,6b,6c-hexahydro-3,4-bis(2,4,6-trimethylphenyl)-, (3a.alpha.,3b.beta.,3c.alpha.,6a.alpha.,6b.beta., 6c.alpha.)-
CAS Registry Number	100854-00-0
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C26H28N2O2
InChI	InChI=1S/C26H28N2O2/c1-11-7-13(3)17(14(4)8-11)23-21-19-20(25(21)29-27-23)22-24(28-30-26(19)22)18-15(5)9-12(2)10-16(18)6/h7-10,19-22,25-26H,1-6H3
InChIKey	NSCHIGGJVBCIJB-UHFFFAOYSA-N
Molecular Weight	400.522 g/mol
SMILES	C12C(=NOC2C2C3C(c4c(cc(cc4C)C)C)=NOC3C12)c1c(cc(cc1C)C)C
SPLASH	splash10-0a4i-0900100000-2102d0225bb5d60a744c
Source of Spectrum	K-118-4219-18
Synonyms	3,6-dimesityl-3a,3b,3c,6a,6b,6c-hexahydroisoxazolo[5'',4'':3',4']cyclobuta[1',2':3,4]cyclobuta[1,2-d]isoxazole 5,11-bis-(2,4,6-trimethylphenyl)-3,9-dioxa-4,10-diaza-exo,exo-tetracyclo[5.5.0.0(2,6).0(8,12)]dodeca-4,10-dien Isoxazolo[4'',5'':3',4']cyclobuta[1',2':3,4]cyclobut[1,2-d]isoxazole, 3a,3b,3c,6a,6b,6c-hexahydro-3,4-bis(2,4,6-trimethylphenyl)-, (3a.alpha.,3b.beta.,3c.alpha.,6a.alpha.,6b.beta., 6c.alpha.)-
Wiley ID	1369627