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2-chloro-5-[3,5-dioxo-10-(propan-2-ylidene)-4-azatricyclo[5.2.1.0²,⁶]dec-8-en-4-yl]benzoic acid
SpectraBase Compound ID 5ZfuAZYueNA
InChI InChI=1S/C19H16ClNO4/c1-8(2)14-10-4-5-11(14)16-15(10)17(22)21(18(16)23)9-3-6-13(20)12(7-9)19(24)25/h3-7,10-11,15-16H,1-2H3,(H,24,25)/t10-,11+,15?,16?
InChIKey MUMUGSSTSUBRAT-IUOZQUQDSA-N
Mol Weight 357.79 g/mol
Molecular Formula C19H16ClNO4
Exact Mass 357.076786 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7hNxY4jaAKp
Name 2-chloro-5-[3,5-dioxo-10-(propan-2-ylidene)-4-azatricyclo[5.2.1.0²,⁶]dec-8-en-4-yl]benzoic acid
Copyright Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 357.076785695 u
Formula C19H16ClNO4
InChI InChI=1S/C19H16ClNO4/c1-8(2)14-10-4-5-11(14)16-15(10)17(22)21(18(16)23)9-3-6-13(20)12(7-9)19(24)25/h3-7,10-11,15-16H,1-2H3,(H,24,25)/t10-,11+,15?,16?
InChIKey MUMUGSSTSUBRAT-IUOZQUQDSA-N
Molecular Weight 357.793 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17
Solvent DMSO-d6
Source Vendor ID: ZI/8070062; Lab Info: LD; Lab Number: LD-3100220
Temperature 29.85 °C