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1-phenyl-3-[2-[[[2-(phenylcarbamoylamino)benzoyl]amino]carbamoyl]phenyl]urea
SpectraBase Compound ID JI6rPopux5x
InChI InChI=1S/C28H24N6O4/c35-25(21-15-7-9-17-23(21)31-27(37)29-19-11-3-1-4-12-19)33-34-26(36)22-16-8-10-18-24(22)32-28(38)30-20-13-5-2-6-14-20/h1-18H,(H,33,35)(H,34,36)(H2,29,31,37)(H2,30,32,38)
InChIKey KNTNFYPCVINVGN-UHFFFAOYSA-N
Mol Weight 508.54 g/mol
Molecular Formula C28H24N6O4
Exact Mass 508.185903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I46GJ7iB2MD
Name 1-phenyl-3-[2-[[[2-(phenylcarbamoylamino)benzoyl]amino]carbamoyl]phenyl]urea
Alternate Name(s) 1-phenyl-3-[2-[[[2-(phenylcarbamoylamino)phenyl]carbonylamino]carbamoyl]phenyl]urea 1-[2-[[[[2-[[anilino(oxo)methyl]amino]phenyl]-oxomethyl]hydrazo]-oxomethyl]phenyl]-3-phenylurea
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H24N6O4
InChI InChI=1S/C28H24N6O4/c35-25(21-15-7-9-17-23(21)31-27(37)29-19-11-3-1-4-12-19)33-34-26(36)22-16-8-10-18-24(22)32-28(38)30-20-13-5-2-6-14-20/h1-18H,(H,33,35)(H,34,36)(H2,29,31,37)(H2,30,32,38)
InChIKey KNTNFYPCVINVGN-UHFFFAOYSA-N
Molecular Weight 508.538 g/mol
SMILES N(NC(c1c(cccc1)NC(=O)Nc1ccccc1)=O)C(c1c(cccc1)NC(=O)Nc1ccccc1)=O
SPLASH splash10-0006-9001000000-66135ac5717aac2b130a
Source of Spectrum Y1-31-737-5
Wiley ID 1525885