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3-({[2-(3,4-dimethoxyphenyl)ethyl]amino}carbonyl)-7-(1-methylethylidene)bicyclo[2.2.1]heptane-2-carboxylic acid
SpectraBase Compound ID Gwr4mv7OINl
InChI InChI=1S/C22H29NO5/c1-12(2)18-14-6-7-15(18)20(22(25)26)19(14)21(24)23-10-9-13-5-8-16(27-3)17(11-13)28-4/h5,8,11,14-15,19-20H,6-7,9-10H2,1-4H3,(H,23,24)(H,25,26)/t14-,15+,19-,20-/m1/s1
InChIKey NKPLLLZLJKFVGF-HRYATBACSA-N
Mol Weight 387.48 g/mol
Molecular Formula C22H29NO5
Exact Mass 387.204573 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6iUaGgeskgp
Name 3-({[2-(3,4-dimethoxyphenyl)ethyl]amino}carbonyl)-7-(1-methylethylidene)bicyclo[2.2.1]heptane-2-carboxylic acid
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/C22H29NO5/c1-12(2)18-14-6-7-15(18)20(22(25)26)19(14)21(24)23-10-9-13-5-8-16(27-3)17(11-13)28-4/h5,8,11,14-15,19-20H,6-7,9-10H2,1-4H3,(H,23,24)(H,25,26)/t14-,15+,19-,20-/m1/s1
InChIKey NKPLLLZLJKFVGF-HRYATBACSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_11297
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: UZI/9085868; UBI_ID: UBI-011300
Temperature 318 °C