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2-chloro-5-oxo-4-oxatricyclo[4.2.1.0~3,7~]nonane-9-carboxylic acid
SpectraBase Compound ID 8z0awJhVn5d
InChI InChI=1S/C9H9ClO4/c10-6-2-1-3-5(4(2)8(11)12)9(13)14-7(3)6/h2-7H,1H2,(H,11,12)
InChIKey ZCJNJGNVUGMXST-UHFFFAOYSA-N
Mol Weight 216.62 g/mol
Molecular Formula C9H9ClO4
Exact Mass 216.018936 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IgWcbIGXqqE
Name 2-chloro-5-oxo-4-oxatricyclo[4.2.1.0~3,7~]nonane-9-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/C9H9ClO4/c10-6-2-1-3-5(4(2)8(11)12)9(13)14-7(3)6/h2-7H,1H2,(H,11,12)
InChIKey ZCJNJGNVUGMXST-UHFFFAOYSA-N
NMR Offset 15.3267
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_3100
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/7013873; Labnumber: LD-3100080; IOH_ID: IOH-003101
Temperature 318 °C