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2,6-ditert-butyl-4-[3-(diphenylmethylene)-2,2,4,4-tetramethylcyclobutylidene]-1-cyclohexa-2,5-dienone
SpectraBase Compound ID 8kMMUxzJUp5
InChI InChI=1S/C35H42O/c1-32(2,3)26-21-25(22-27(29(26)36)33(4,5)6)30-34(7,8)31(35(30,9)10)28(23-17-13-11-14-18-23)24-19-15-12-16-20-24/h11-22H,1-10H3
InChIKey NMEAECKVLQZQFW-UHFFFAOYSA-N
Mol Weight 478.7 g/mol
Molecular Formula C35H42O
Exact Mass 478.323566 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EbG1zjhb9Ne
Name 2,6-ditert-butyl-4-[3-(diphenylmethylene)-2,2,4,4-tetramethylcyclobutylidene]-1-cyclohexa-2,5-dienone
Alternate Name(s) 2,6-ditert-butyl-4-[3-(diphenylmethylidene)-2,2,4,4-tetramethyl-cyclobutylidene]cyclohexa-2,5-dien-1-one 4-(3-benzhydrylidene-2,2,4,4-tetramethyl-cyclobutylidene)-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one
CAS Registry Number 107271-51-2
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H42O
InChI InChI=1S/C35H42O/c1-32(2,3)26-21-25(22-27(29(26)36)33(4,5)6)30-34(7,8)31(35(30,9)10)28(23-17-13-11-14-18-23)24-19-15-12-16-20-24/h11-22H,1-10H3
InChIKey NMEAECKVLQZQFW-UHFFFAOYSA-N
Molecular Weight 478.720 g/mol
SMILES C1(C(C)(C)C(C1(C)C)=C1C=C(C(C)(C)C)C(C(=C1)C(C)(C)C)=O)=C(c1ccccc1)c1ccccc1
SPLASH splash10-0a6r-9000700000-2502b267f33327e345d5
Source of Spectrum J-52-2160-29
Wiley ID 1394929