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1-piperazineacetamide, N-(3-chloro-4-methoxyphenyl)-4-(2-pyridinyl)-

View entire compound with spectra: 2 NMR

1-piperazineacetamide, N-(3-chloro-4-methoxyphenyl)-4-(2-pyridinyl)-
SpectraBase Compound ID ICJBE88ZDbx
InChI InChI=1S/C18H21ClN4O2/c1-25-16-6-5-14(12-15(16)19)21-18(24)13-22-8-10-23(11-9-22)17-4-2-3-7-20-17/h2-7,12H,8-11,13H2,1H3,(H,21,24)
InChIKey KOUKBVJVWQGBLQ-UHFFFAOYSA-N
Mol Weight 360.85 g/mol
Molecular Formula C18H21ClN4O2
Exact Mass 360.135304 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9wQT0VDPgY
Name 1-Piperazineacetamide, N-(3-chloro-4-methoxyphenyl)-4-(2-pyridinyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 360.135303630 u
Formula C18H21ClN4O2
InChI InChI=1S/C18H21ClN4O2/c1-25-16-6-5-14(12-15(16)19)21-18(24)13-22-8-10-23(11-9-22)17-4-2-3-7-20-17/h2-7,12H,8-11,13H2,1H3,(H,21,24)
InChIKey KOUKBVJVWQGBLQ-UHFFFAOYSA-N
Molecular Weight 360.845 g/mol
SMILES N(C(CN1CCN(C=2N=CC=CC2)CC1)=O)C1=CC(Cl)=C(C=C1)OC