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N-Adamantan-1-ylmethyl-2-(5-chloro-benzothiazol-2-ylsulfanyl)-acetamide

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N-Adamantan-1-ylmethyl-2-(5-chloro-benzothiazol-2-ylsulfanyl)-acetamide
SpectraBase Compound ID JYHTE0LJYr2
InChI InChI=1S/C20H23ClN2OS2/c21-15-1-2-17-16(6-15)23-19(26-17)25-10-18(24)22-11-20-7-12-3-13(8-20)5-14(4-12)9-20/h1-2,6,12-14H,3-5,7-11H2,(H,22,24)/t12-,13+,14-,20-
InChIKey PCAJPLINOITFRY-OYEQCZOJSA-N
Mol Weight 406.99 g/mol
Molecular Formula C20H23ClN2OS2
Exact Mass 406.094033 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3OsKmouSh4C
Name acetamide, 2-[(5-chloro-2-benzothiazolyl)thio]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 406.094033416 u
Formula C20H23ClN2OS2
InChI InChI=1S/C20H23ClN2OS2/c21-15-1-2-17-16(6-15)23-19(26-17)25-10-18(24)22-11-20-7-12-3-13(8-20)5-14(4-12)9-20/h1-2,6,12-14H,3-5,7-11H2,(H,22,24)/t12-,13+,14-,20-
InChIKey PCAJPLINOITFRY-OYEQCZOJSA-N
Molecular Weight 406.990 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15968
Solvent DMSO-d6
Source Vendor ID: NMR/11220785; Lab Info: KTS; Lab Number: KTS-0103010