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Carbamic acid, [2-[[2-(1H-1,3-benzimidazol-2-yl)ethyl]amino]-1-methyl-2-oxoethyl]-, 1,1-dimethylethyl ester
SpectraBase Compound ID AaiFNfC9OEJ
InChI InChI=1S/C17H24N4O3/c1-11(19-16(23)24-17(2,3)4)15(22)18-10-9-14-20-12-7-5-6-8-13(12)21-14/h5-8,11H,9-10H2,1-4H3,(H,18,22)(H,19,23)(H,20,21)
InChIKey CMIWLACQHWIALC-UHFFFAOYSA-N
Mol Weight 332.4 g/mol
Molecular Formula C17H24N4O3
Exact Mass 332.184841 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E0VKvHMtLPX
Name Carbamic acid, [2-[[2-(1H-1,3-benzimidazol-2-yl)ethyl]amino]-1-methyl-2-oxoethyl]-, 1,1-dimethylethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 332.184840646 u
Formula C17H24N4O3
InChI InChI=1S/C17H24N4O3/c1-11(19-16(23)24-17(2,3)4)15(22)18-10-9-14-20-12-7-5-6-8-13(12)21-14/h5-8,11H,9-10H2,1-4H3,(H,18,22)(H,19,23)(H,20,21)
InChIKey CMIWLACQHWIALC-UHFFFAOYSA-N
Molecular Weight 332.404 g/mol
SMILES C(C(NCCC=1NC2=CC=CC=C2N1)=O)(C)NC(=O)OC(C)(C)C