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2-chloro-1-(chloromethyl)ethyl 3-{[(7-methyl-1,3-benzothiazol-2-yl)amino]carbonyl}bicyclo[2.2.1]hept-5-ene-2-carboxylate
SpectraBase Compound ID 2koKxV7MHIq
InChI InChI=1S/C20H20Cl2N2O3S/c1-10-3-2-4-14-17(10)28-20(23-14)24-18(25)15-11-5-6-12(7-11)16(15)19(26)27-13(8-21)9-22/h2-6,11-13,15-16H,7-9H2,1H3,(H,23,24,25)
InChIKey JILVMJIBZXMCPT-UHFFFAOYSA-N
Mol Weight 439.36 g/mol
Molecular Formula C20H20Cl2N2O3S
Exact Mass 438.057169 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DrZy27yPeHP
Name 2-chloro-1-(chloromethyl)ethyl 3-{[(7-methyl-1,3-benzothiazol-2-yl)amino]carbonyl}bicyclo[2.2.1]hept-5-ene-2-carboxylate
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/C20H20Cl2N2O3S/c1-10-3-2-4-14-17(10)28-20(23-14)24-18(25)15-11-5-6-12(7-11)16(15)19(26)27-13(8-21)9-22/h2-6,11-13,15-16H,7-9H2,1H3,(H,23,24,25)
InChIKey JILVMJIBZXMCPT-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_18874
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: UZI/9130705; UBI_ID: UBI-018877
Temperature 313 °C