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3(2H)-Benzothiazolepropanoic acid, 2-oxo-, cyclohexyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3(2H)-Benzothiazolepropanoic acid, 2-oxo-, cyclohexyl ester
SpectraBase Compound ID 73qSTLFEHzt
InChI InChI=1S/C16H19NO3S/c18-15(20-12-6-2-1-3-7-12)10-11-17-13-8-4-5-9-14(13)21-16(17)19/h4-5,8-9,12H,1-3,6-7,10-11H2
InChIKey YCGXQAMZGANIMQ-UHFFFAOYSA-N
Mol Weight 305.39 g/mol
Molecular Formula C16H19NO3S
Exact Mass 305.108565 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I1sWbyaw6b5
Name cyclohexyl 3-(2-oxo-1,3-benzothiazol-3(2H)-yl)propanoate
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/C16H19NO3S/c18-15(20-12-6-2-1-3-7-12)10-11-17-13-8-4-5-9-14(13)21-16(17)19/h4-5,8-9,12H,1-3,6-7,10-11H2
InChIKey YCGXQAMZGANIMQ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_15783
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: 987/00002631; Labnumber: 987/00002631218831; VK_ID: VK-015788
Temperature 308 °C