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GDFCZZHSWGWCHP-UHFFFAOYSA-N

View entire compound with spectra: 3 NMR

GDFCZZHSWGWCHP-UHFFFAOYSA-N
SpectraBase Compound ID BRhdMHduBPL
InChI InChI=1S/C8H5N3S/c9-4-5-1-2-6-7(3-5)12-8(10)11-6/h1-3H,(H2,10,11)
InChIKey GDFCZZHSWGWCHP-UHFFFAOYSA-N
Mol Weight 175.21 g/mol
Molecular Formula C8H5N3S
Exact Mass 175.020418 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HuJbQznkJ97
Name 2-AMINOBENZOTHIAZOL-6-CARBONITRIL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H5N3S
InChI InChI=1S/C8H5N3S/c9-4-5-1-2-6-7(3-5)12-8(10)11-6/h1-3H,(H2,10,11)
InChIKey GDFCZZHSWGWCHP-UHFFFAOYSA-N
Literature Reference Author S.N.SAWHNEY,D.W.BOYKIN
Literature Reference Citation J.ORG.CHEM.,44,1136(1979)
Literature Reference DOI 10.1021/jo01321a024
Molecular Weight 175.208 g/mol
Solvent DMSO
Source File Reference UNIW8966