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N-[(12Z)-6-Oxidodibenzo-[D,H]-[1,3,6,2]-oxathiazaphosphonin-6-yl]-ethane-1,2-diamine
SpectraBase Compound ID 6Uq7YbK11Zq
InChI InChI=1S/C15H16N3O2PS/c16-9-10-18-21(19)20-14-7-3-1-5-12(14)11-17-13-6-2-4-8-15(13)22-21/h1-8,11H,9-10,16H2,(H,18,19)/b17-11-
InChIKey MWYUCJOCIWVEHQ-BOPFTXTBSA-N
Mol Weight 333.35 g/mol
Molecular Formula C15H16N3O2PS
Exact Mass 333.070085 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D7YVjvNy1gX
Name N-[(12Z)-6-Oxidodibenzo-[D,H]-[1,3,6,2]-oxathiazaphosphonin-6-yl]-ethane-1,2-diamine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 333.070084937 u
Formula C15H16N3O2PS
InChI InChI=1S/C15H16N3O2PS/c16-9-10-18-21(19)20-14-7-3-1-5-12(14)11-17-13-6-2-4-8-15(13)22-21/h1-8,11H,9-10,16H2,(H,18,19)/b17-11-
InChIKey MWYUCJOCIWVEHQ-BOPFTXTBSA-N
Molecular Weight 333.346 g/mol
SMILES C1=2\C=N/C=3C(SP(OC1=CC=CC2)(=O)NCCN)=CC=CC3