3-[3-(5-Amino-[1,3,4]thiadiazol-2-yl)-propyl]-3H-benzooxazol-2-one

SpectraBase Compound ID	4fZ5l65A0wk
InChI	InChI=1S/C12H12N4O2S/c13-11-15-14-10(19-11)6-3-7-16-8-4-1-2-5-9(8)18-12(16)17/h1-2,4-5H,3,6-7H2,(H2,13,15)
InChIKey	OCEPKMJMFYLDKL-UHFFFAOYSA-N Google Search
Mol Weight	276.31 g/mol
Molecular Formula	C12H12N4O2S
Exact Mass	276.068097 g/mol

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SpectraBase Spectrum ID	8lOcNBOBwS3
Name	2(3H)-benzoxazolone, 3-[3-(5-amino-1,3,4-thiadiazol-2-yl)propyl]-
Copyright	Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	276.068096814 u
Formula	C12H12N4O2S
InChI	InChI=1S/C12H12N4O2S/c13-11-15-14-10(19-11)6-3-7-16-8-4-1-2-5-9(8)18-12(16)17/h1-2,4-5H,3,6-7H2,(H2,13,15)
InChIKey	OCEPKMJMFYLDKL-UHFFFAOYSA-N
Molecular Weight	276.314 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_16151
Solvent	DMSO-d6
Source	Vendor ID: NMR/10320239; Lab Info: SAD; Lab Number: 37