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4-phenoxybutyric acid, (2,3,4,5-tetrahydro-1-benzothiepin-5-ylidene)hydrazide, S,S-dioxide
SpectraBase Compound ID BfCG9p7kBxl
InChI InChI=1S/C20H22N2O4S/c23-20(13-6-14-26-16-8-2-1-3-9-16)22-21-18-11-7-15-27(24,25)19-12-5-4-10-17(18)19/h1-5,8-10,12H,6-7,11,13-15H2,(H,22,23)/b21-18+
InChIKey IOPJBPXRIBSFMW-DYTRJAOYSA-N
Mol Weight 386.47 g/mol
Molecular Formula C20H22N2O4S
Exact Mass 386.130028 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Epvr9hwbozX
Name 4-phenoxybutyric acid, (2,3,4,5-tetrahydro-1-benzothiepin-5-ylidene)hydrazide, S,S-dioxide
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Formula C20H22N2O4S
InChI InChI=1S/C20H22N2O4S/c23-20(13-6-14-26-16-8-2-1-3-9-16)22-21-18-11-7-15-27(24,25)19-12-5-4-10-17(18)19/h1-5,8-10,12H,6-7,11,13-15H2,(H,22,23)/b21-18+
InChIKey IOPJBPXRIBSFMW-DYTRJAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 40910M
Solvent Polysol