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3-[(tert-Butyl)amino]-4-(dibenzylamino)-1H-2-benzopyran-1-one
SpectraBase Compound ID 3PcZdVwRiqE
InChI InChI=1S/C27H28N2O2/c1-27(2,3)28-25-24(22-16-10-11-17-23(22)26(30)31-25)29(18-20-12-6-4-7-13-20)19-21-14-8-5-9-15-21/h4-17,28H,18-19H2,1-3H3
InChIKey ZGJOEIMJQJJFHU-UHFFFAOYSA-N
Mol Weight 412.53 g/mol
Molecular Formula C27H28N2O2
Exact Mass 412.215078 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DJJyTln7Lsk
Name 3-[(tert-Butyl)amino]-4-(dibenzylamino)-1H-2-benzopyran-1-one
Alternate Name(s) 3-(tert-butylamino)-4-(dibenzylamino)-1H-isochromen-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H28N2O2
InChI InChI=1S/C27H28N2O2/c1-27(2,3)28-25-24(22-16-10-11-17-23(22)26(30)31-25)29(18-20-12-6-4-7-13-20)19-21-14-8-5-9-15-21/h4-17,28H,18-19H2,1-3H3
InChIKey ZGJOEIMJQJJFHU-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201000124
Molecular Weight 412.533 g/mol
SMILES N(C(C)(C)C)C1=C(c2c(C(O1)=O)cccc2)N(Cc1ccccc1)Cc1ccccc1
SPLASH splash10-006x-9440000000-05630d02c1e92d0614c6
Source of Spectrum H-93-2207-4a
Wiley ID 1783932