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IOUPHQSPQSPNIO-UHFFFAOYSA-N
SpectraBase Compound ID 2SnBtR4y6dv
InChI InChI=1S/C9H7ClN2/c10-8-6-11-12-9(8)7-4-2-1-3-5-7/h1-6H,(H,11,12)
InChIKey IOUPHQSPQSPNIO-UHFFFAOYSA-N
Mol Weight 178.62 g/mol
Molecular Formula C9H7ClN2
Exact Mass 178.029776 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5MXKARZcRjC
Name IOUPHQSPQSPNIO-UHFFFAOYSA-N
Compound Number 53
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H7ClN2
InChI InChI=1S/C9H7ClN2/c10-8-6-11-12-9(8)7-4-2-1-3-5-7/h1-6H,(H,11,12)
InChIKey IOUPHQSPQSPNIO-UHFFFAOYSA-N
Literature Reference Author M.BEGTRUP,G.BOYER,P.CABILDO,C.CATIVIELA,R.M.CLARAMUNT,J.ELGU ERO,J.I.GARCIA,C.TOI
Literature Reference Citation MAGN.RES.CHEM.,31,107(1993)
Literature Reference DOI 10.1002/mrc.1260310202
Molecular Weight 178.621 g/mol
Solvent DMSO-D6
Source File Reference UWVP1802