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6H-dibenzo[b,f][1,4,5]oxathiazepine-3-carboxylic acid, 2-chloro-6,8-dimethyl-, methyl ester, 5,5-dioxide
SpectraBase Compound ID KTagZF9I0Ye
InChI InChI=1S/C16H14ClNO5S/c1-9-4-5-13-12(6-9)18(2)24(20,21)15-7-10(16(19)22-3)11(17)8-14(15)23-13/h4-8H,1-3H3
InChIKey PNLCUWYDOWYDEB-UHFFFAOYSA-N
Mol Weight 367.8 g/mol
Molecular Formula C16H14ClNO5S
Exact Mass 367.028121 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4vwA7VPBTg0
Name 6H-dibenzo[b,f][1,4,5]oxathiazepine-3-carboxylic acid, 2-chloro-6,8-dimethyl-, methyl ester, 5,5-dioxide
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/C16H14ClNO5S/c1-9-4-5-13-12(6-9)18(2)24(20,21)15-7-10(16(19)22-3)11(17)8-14(15)23-13/h4-8H,1-3H3
InChIKey PNLCUWYDOWYDEB-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_7312
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: NMR/18301419; Labnumber: SP-X001378