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4-methyl-2-{[(1-propyl-1H-benzimidazol-2-yl)amino]methyl}phenol

View entire compound with spectra: 2 NMR

4-methyl-2-{[(1-propyl-1H-benzimidazol-2-yl)amino]methyl}phenol
SpectraBase Compound ID EQ2i6H97QXd
InChI InChI=1S/C18H21N3O/c1-3-10-21-16-7-5-4-6-15(16)20-18(21)19-12-14-11-13(2)8-9-17(14)22/h4-9,11,22H,3,10,12H2,1-2H3,(H,19,20)
InChIKey MQWMBWVDNCWEFV-UHFFFAOYSA-N
Mol Weight 295.39 g/mol
Molecular Formula C18H21N3O
Exact Mass 295.168462 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JP7l0iTuuaL
Name 4-Methyl-2-{[(1-propyl-1H-benzimidazol-2-yl)amino]methyl}phenol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 295.168462307 u
Formula C18H21N3O
InChI InChI=1S/C18H21N3O/c1-3-10-21-16-7-5-4-6-15(16)20-18(21)19-12-14-11-13(2)8-9-17(14)22/h4-9,11,22H,3,10,12H2,1-2H3,(H,19,20)
InChIKey MQWMBWVDNCWEFV-UHFFFAOYSA-N
Molecular Weight 295.386 g/mol
SMILES N(C1=NC=2C=CC=CC2N1CCC)CC1=C(C=CC(=C1)C)O