SpectraBase Compound ID | CBdxZzB1ugQ |
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InChI | InChI=1S/C17H12ClN3O5S/c18-16-15(10-19-20(17(16)22)13-4-2-1-3-5-13)27(25,26)11-12-6-8-14(9-7-12)21(23)24/h1-10H,11H2 |
InChIKey | NXTGQKMSQRTGKK-UHFFFAOYSA-N |
Mol Weight | 405.81 g/mol |
Molecular Formula | C17H12ClN3O5S |
Exact Mass | 405.018619 g/mol |
SpectraBase Spectrum ID | 6nGPDkbit9v |
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Name | 3(2H)-Pyridazinone, 4-chloro-5-[[(4-nitrophenyl)methyl]sulfonyl]-2-phenyl- |
CAS Registry Number | 97137-27-4 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C17H12ClN3O5S |
InChI | InChI=1S/C17H12ClN3O5S/c18-16-15(10-19-20(17(16)22)13-4-2-1-3-5-13)27(25,26)11-12-6-8-14(9-7-12)21(23)24/h1-10H,11H2 |
InChIKey | NXTGQKMSQRTGKK-UHFFFAOYSA-N |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |