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N-CYANO-4-(p-NITROPHENYL)THIO-1-PIPERAZINECARBIMIDIC ACID, METHYL ESTER
SpectraBase Compound ID EgdcjXwprjv
InChI InChI=1S/C13H15N5O2S/c1-21-13(15-10-14)17-8-6-16(7-9-17)11-2-4-12(5-3-11)18(19)20/h2-5H,6-9H2,1H3/b15-13-
InChIKey BGOVDQBUQRSQII-SQFISAMPSA-N
Mol Weight 305.36 g/mol
Molecular Formula C13H15N5O2S
Exact Mass 305.094646 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9ClWxRFeQeU
Name N-CYANO-4-(p-NITROPHENYL)THIO-1-PIPERAZINECARBIMIDIC ACID, METHYL ESTER
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15N5O2S
InChI InChI=1S/C13H15N5O2S/c1-21-13(15-10-14)17-8-6-16(7-9-17)11-2-4-12(5-3-11)18(19)20/h2-5H,6-9H2,1H3/b15-13-
InChIKey BGOVDQBUQRSQII-SQFISAMPSA-N
Instrument Name BRUKER AC-300
Melting Point 169-171C
Molecular Weight 305.36
Solvent DMSO-d6; Reference=TMS; Temperature 297K