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6-acetyl-5-methyl-4H,5H,6H-[1,3]thiazolo[3,2-a][1,5]benzodiazepin-11-ium bromide
SpectraBase Compound ID 1WuiCvTxPiP
InChI InChI=1S/C14H15N2OS.BrH/c1-10-9-14-15(7-8-18-14)12-5-3-4-6-13(12)16(10)11(2)17;/h3-8,10H,9H2,1-2H3;1H/q+1;/p-1
InChIKey BUWDXBAFBZNBED-UHFFFAOYSA-M
Mol Weight 339.25 g/mol
Molecular Formula C14H15BrN2OS
Exact Mass 338.008847 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID YY65LYRBs
Name 6-acetyl-5-methyl-4H,5H,6H-[1,3]thiazolo[3,2-a][1,5]benzodiazepin-11-ium bromide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 338.008847284 u
Formula C14H15BrN2OS
InChI InChI=1S/C14H15N2OS.BrH/c1-10-9-14-15(7-8-18-14)12-5-3-4-6-13(12)16(10)11(2)17;/h3-8,10H,9H2,1-2H3;1H/q+1;/p-1
InChIKey BUWDXBAFBZNBED-UHFFFAOYSA-M
Molecular Weight 339.251 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_5787
Solvent DMSO-d6
Source Vendor ID: NMR/12273473; Lab Info: YAN; Lab Number: YAN-0209010