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3-[(3-bromoanilino)carbonyl]-7-(1-methylethylidene)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
SpectraBase Compound ID BfvWhmqhvXQ
InChI InChI=1S/C18H18BrNO3/c1-9(2)14-12-6-7-13(14)16(18(22)23)15(12)17(21)20-11-5-3-4-10(19)8-11/h3-8,12-13,15-16H,1-2H3,(H,20,21)(H,22,23)/t12-,13+,15-,16-/m1/s1
InChIKey YBTFHOYKUHDUOB-OCVGTWLNSA-N
Mol Weight 376.25 g/mol
Molecular Formula C18H18BrNO3
Exact Mass 375.047006 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JnX7ehhPYce
Name 3-[(3-bromoanilino)carbonyl]-7-(1-methylethylidene)bicyclo[2.2.1]hept-5-ene-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/C18H18BrNO3/c1-9(2)14-12-6-7-13(14)16(18(22)23)15(12)17(21)20-11-5-3-4-10(19)8-11/h3-8,12-13,15-16H,1-2H3,(H,20,21)(H,22,23)/t12-,13+,15-,16-/m1/s1
InChIKey YBTFHOYKUHDUOB-OCVGTWLNSA-N
NMR Offset 16.524
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_4592
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: ZI/7028047; Labnumber: 27; IOH_ID: IOH-004593
Temperature 313 °C