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3-{[4-(ethoxycarbonyl)anilino]carbonyl}-7-(1-methylethylidene)bicyclo[2.2.1]heptane-2-carboxylic acid
SpectraBase Compound ID 5Ekr39nJn2j
InChI InChI=1S/C21H25NO5/c1-4-27-21(26)12-5-7-13(8-6-12)22-19(23)17-14-9-10-15(16(14)11(2)3)18(17)20(24)25/h5-8,14-15,17-18H,4,9-10H2,1-3H3,(H,22,23)(H,24,25)/t14-,15+,17-,18-/m1/s1
InChIKey RASSOCXEEAYAHT-CYGHRXIMSA-N
Mol Weight 371.43 g/mol
Molecular Formula C21H25NO5
Exact Mass 371.173273 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GI11zb8qtCl
Name 3-{[4-(ethoxycarbonyl)anilino]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/C21H25NO5/c1-4-27-21(26)12-5-7-13(8-6-12)22-19(23)17-14-9-10-15(16(14)11(2)3)18(17)20(24)25/h5-8,14-15,17-18H,4,9-10H2,1-3H3,(H,22,23)(H,24,25)/t14-,15+,17-,18-/m1/s1
InChIKey RASSOCXEEAYAHT-CYGHRXIMSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_11623
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/9093195; UBI_ID: UBI-011626
Temperature 318 °C