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1H-Imidazole-2,5-dione, 4-[[4-(1,3-benzodioxol-5-ylmethyl)-1-methyl-1H-imidazol-2-yl]amino]-1-methyl-
SpectraBase Compound ID 9RS337SuK0Z
InChI InChI=1S/C16H15N5O4/c1-20-7-10(5-9-3-4-11-12(6-9)25-8-24-11)17-15(20)18-13-14(22)21(2)16(23)19-13/h3-4,6-7H,5,8H2,1-2H3,(H,17,18,19,23)
InChIKey DNQGARKMDHLOGM-UHFFFAOYSA-N
Mol Weight 341.33 g/mol
Molecular Formula C16H15N5O4
Exact Mass 341.112404 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6D1gD0aSC9j
Name 1H-Imidazole-2,5-dione, 4-[[4-(1,3-benzodioxol-5-ylmethyl)-1-methyl-1H-imidazol-2-yl]amino]-1-methyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 341.112403979 u
Formula C16H15N5O4
InChI InChI=1S/C16H15N5O4/c1-20-7-10(5-9-3-4-11-12(6-9)25-8-24-11)17-15(20)18-13-14(22)21(2)16(23)19-13/h3-4,6-7H,5,8H2,1-2H3,(H,17,18,19,23)
InChIKey DNQGARKMDHLOGM-UHFFFAOYSA-N
Molecular Weight 341.327 g/mol
SMILES C1(=NC(N(C1=O)C)=O)NC1=NC(CC=2C=C3OCOC3=CC2)=CN1C