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4-(Dibenzylamino)-3-[(1,1,3,3-tetramethylbutyl)amino]-1H-2-benzopyran-1-one
SpectraBase Compound ID BlCjE3LJ2Ww
InChI InChI=1S/C31H36N2O2/c1-30(2,3)22-31(4,5)32-28-27(25-18-12-13-19-26(25)29(34)35-28)33(20-23-14-8-6-9-15-23)21-24-16-10-7-11-17-24/h6-19,32H,20-22H2,1-5H3
InChIKey XBWSUVCBUPEMEJ-UHFFFAOYSA-N
Mol Weight 468.6 g/mol
Molecular Formula C31H36N2O2
Exact Mass 468.277678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 11v42EDwByJ
Name 4-(Dibenzylamino)-3-[(1,1,3,3-tetramethylbutyl)amino]-1H-2-benzopyran-1-one
Alternate Name(s) 4-(dibenzylamino)-3-((2,4,4-trimethylpentan-2-yl)amino)-1H-isochromen-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H36N2O2
InChI InChI=1S/C31H36N2O2/c1-30(2,3)22-31(4,5)32-28-27(25-18-12-13-19-26(25)29(34)35-28)33(20-23-14-8-6-9-15-23)21-24-16-10-7-11-17-24/h6-19,32H,20-22H2,1-5H3
InChIKey XBWSUVCBUPEMEJ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201000124
Molecular Weight 468.641 g/mol
SMILES N(C(CC(C)(C)C)(C)C)C=1OC(c2c(cccc2)C1N(Cc1ccccc1)Cc1ccccc1)=O
SPLASH splash10-0597-9440000000-2962f7267806ed4b4cb3
Source of Spectrum H-93-2208-4c
Wiley ID 1783934