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VDJKNNUMMBGGCH-UHFFFAOYSA-N

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VDJKNNUMMBGGCH-UHFFFAOYSA-N
SpectraBase Compound ID EI248ymm23C
InChI InChI=1S/C14H11N3S/c1-17-8-9-10(16-17)6-7-12-14(9)18-13-5-3-2-4-11(13)15-12/h2-8,15H,1H3
InChIKey VDJKNNUMMBGGCH-UHFFFAOYSA-N
Mol Weight 253.32 g/mol
Molecular Formula C14H11N3S
Exact Mass 253.067369 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6721pJ0rL5u
Name VDJKNNUMMBGGCH-UHFFFAOYSA-N
Compound Number 2D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H11N3S
InChI InChI=1S/C14H11N3S/c1-17-8-9-10(16-17)6-7-12-14(9)18-13-5-3-2-4-11(13)15-12/h2-8,15H,1H3
InChIKey VDJKNNUMMBGGCH-UHFFFAOYSA-N
Literature Reference Author G.BOYER,J.P.GALY,R.FAURE,J.BARBE
Literature Reference Citation MAGN.RES.CHEM.,32,537(1994)
Literature Reference DOI 10.1002/mrc.1260320907
Molecular Weight 253.321 g/mol
Solvent DMSO-D6
Source File Reference UWCP824