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1-piperazineacetamide, 4-[(4-fluorophenyl)sulfonyl]-N-(2-methoxyphenyl)-
SpectraBase Compound ID BwzW1fy9wiZ
InChI InChI=1S/C19H22FN3O4S/c1-27-18-5-3-2-4-17(18)21-19(24)14-22-10-12-23(13-11-22)28(25,26)16-8-6-15(20)7-9-16/h2-9H,10-14H2,1H3,(H,21,24)
InChIKey OVYOQXWWRDOPSI-UHFFFAOYSA-N
Mol Weight 407.46 g/mol
Molecular Formula C19H22FN3O4S
Exact Mass 407.131506 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IAxwdpz0TMw
Name 1-Piperazineacetamide, 4-[(4-fluorophenyl)sulfonyl]-N-(2-methoxyphenyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 407.131505533 u
Formula C19H22FN3O4S
InChI InChI=1S/C19H22FN3O4S/c1-27-18-5-3-2-4-17(18)21-19(24)14-22-10-12-23(13-11-22)28(25,26)16-8-6-15(20)7-9-16/h2-9H,10-14H2,1H3,(H,21,24)
InChIKey OVYOQXWWRDOPSI-UHFFFAOYSA-N
Molecular Weight 407.460 g/mol
SMILES N(C(CN1CCN(S(C2=CC=C(C=C2)F)(=O)=O)CC1)=O)C1=C(OC)C=CC=C1