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N,N'-Bis(2,2-benzoylacetic)isophthalamide

View entire compound with spectra: 1 MS (GC)

N,N'-Bis(2,2-benzoylacetic)isophthalamide
SpectraBase Compound ID JsuXHRMDu4P
InChI InChI=1S/C26H20N2O8/c29-21(13-23(31)32)17-8-1-3-10-19(17)27-25(35)15-6-5-7-16(12-15)26(36)28-20-11-4-2-9-18(20)22(30)14-24(33)34/h1-12H,13-14H2,(H,27,35)(H,28,36)(H,31,32)(H,33,34)
InChIKey ITXVXYDOWABREC-UHFFFAOYSA-N
Mol Weight 488.45 g/mol
Molecular Formula C26H20N2O8
Exact Mass 488.121966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DwyjYNKHdrY
Name N,N'-Bis(2,2-benzoylacetic)isophthalamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H20N2O8
InChI InChI=1S/C26H20N2O8/c29-21(13-23(31)32)17-8-1-3-10-19(17)27-25(35)15-6-5-7-16(12-15)26(36)28-20-11-4-2-9-18(20)22(30)14-24(33)34/h1-12H,13-14H2,(H,27,35)(H,28,36)(H,31,32)(H,33,34)
InChIKey ITXVXYDOWABREC-UHFFFAOYSA-N
Molecular Weight 488.452 g/mol
SMILES N(C(c1cc(C(Nc2c(C(CC(=O)O)=O)cccc2)=O)ccc1)=O)c1c(C(CC(=O)O)=O)cccc1
SPLASH splash10-006x-0009100000-2459971ab0af5e7f3ad1
Source of Spectrum Y1-36-363-3
Wiley ID 1527030