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2-(3-oxo-3-(4-phenylpiperazin-1-yl)propyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
SpectraBase Compound ID CehLmnMA6Bx
InChI InChI=1S/C22H25N3O3/c26-18(24-12-10-23(11-13-24)17-4-2-1-3-5-17)8-9-25-21(27)19-15-6-7-16(14-15)20(19)22(25)28/h1-7,15-16,19-20H,8-14H2
InChIKey XCLFUGJCXBAPLR-UHFFFAOYSA-N
Mol Weight 379.46 g/mol
Molecular Formula C22H25N3O3
Exact Mass 379.189592 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IlQHfsUL7jy
Name 2-(3-oxo-3-(4-phenylpiperazin-1-yl)propyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C22H25N3O3/c26-18(24-12-10-23(11-13-24)17-4-2-1-3-5-17)8-9-25-21(27)19-15-6-7-16(14-15)20(19)22(25)28/h1-7,15-16,19-20H,8-14H2
InChIKey XCLFUGJCXBAPLR-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_1553
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/11259791