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3,5-Di-t-Butyl-4-hydroxyphenylbis(1,2-dihydro-N-methyl-2-oxocyclohepta[b]pyrrol-3-yl)methane
SpectraBase Compound ID 21kk1BLtSZK
InChI InChI=1S/C35H38N2O3/c1-34(2,3)24-19-21(20-25(31(24)38)35(4,5)6)28(29-22-15-11-9-13-17-26(22)36(7)32(29)39)30-23-16-12-10-14-18-27(23)37(8)33(30)40/h9-20,28,38H,1-8H3
InChIKey BIOFZZMBXUKQIV-UHFFFAOYSA-N
Mol Weight 534.7 g/mol
Molecular Formula C35H38N2O3
Exact Mass 534.288243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GmAsWuZYTrF
Name 3,5-Di-t-Butyl-4-hydroxyphenylbis(1,2-dihydro-N-methyl-2-oxocyclohepta[b]pyrrol-3-yl)methane
Alternate Name(s) 3-[(3,5-ditert-butyl-4-hydroxyphenyl)(1-methyl-2-oxo-1,2-dihydrocyclohepta[b]pyrrol-3-yl)methyl]-1-methylcyclohepta[b]pyrrol-2(1H)-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H38N2O3
InChI InChI=1S/C35H38N2O3/c1-34(2,3)24-19-21(20-25(31(24)38)35(4,5)6)28(29-22-15-11-9-13-17-26(22)36(7)32(29)39)30-23-16-12-10-14-18-27(23)37(8)33(30)40/h9-20,28,38H,1-8H3
InChIKey BIOFZZMBXUKQIV-UHFFFAOYSA-N
Molecular Weight 534.700 g/mol
SMILES Oc1c(cc(C(C=2C(N(C)C=3C2C=CC=CC3)=O)C=2C(N(C)C=3C2C=CC=CC3)=O)cc1C(C)(C)C)C(C)(C)C
SPLASH splash10-0a4i-9000030000-2d3bf7591ef0e9a23cf4
Source of Spectrum AJ-76-2040-8
Wiley ID 1577375