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o-Tolylsulfanyl-acetic acid (4-chloro-benzylidene)-hydrazide

View entire compound with spectra: 1 NMR, and 1 MS (GC)

o-Tolylsulfanyl-acetic acid (4-chloro-benzylidene)-hydrazide
SpectraBase Compound ID KWogdrDVpRB
InChI InChI=1S/C16H15ClN2OS/c1-12-4-2-3-5-15(12)21-11-16(20)19-18-10-13-6-8-14(17)9-7-13/h2-10H,11H2,1H3,(H,19,20)/b18-10+
InChIKey BAIWDIPHPJOKHY-VCHYOVAHSA-N
Mol Weight 318.82 g/mol
Molecular Formula C16H15ClN2OS
Exact Mass 318.059362 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5RJ9nMRRu02
Name o-Tolylsulfanyl-acetic acid (4-chloro-benzylidene)-hydrazide
Comments Computed using HOSE algorithm
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Exact Mass 318.059361984 u
Formula C16H15ClN2OS
InChI InChI=1S/C16H15ClN2OS/c1-12-4-2-3-5-15(12)21-11-16(20)19-18-10-13-6-8-14(17)9-7-13/h2-10H,11H2,1H3,(H,19,20)/b18-10+
InChIKey BAIWDIPHPJOKHY-VCHYOVAHSA-N
Molecular Weight 318.822 g/mol
SMILES C(N\N=C\C1=CC=C(C=C1)Cl)(=O)CSC1=CC=CC=C1C