SpectraBase Compound ID | 4DZ427VH3mC |
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InChI | InChI=1S/C9H9NO3S/c1-7(11)6-14-9-5-3-2-4-8(9)10(12)13/h2-5H,6H2,1H3 |
InChIKey | AGNNBHMFRWKZDG-UHFFFAOYSA-N |
Mol Weight | 211.23 g/mol |
Molecular Formula | C9H9NO3S |
Exact Mass | 211.030314 g/mol |
SpectraBase Spectrum ID | 4FcvioDuj54 |
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Name | 1-[(o-NITROPHENYL)THIO]-2-PROPANONE |
Source of Sample | Aldrich Chemical Company, Inc., Milwaukee, Wisconsin |
Copyright | Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C9H9NO3S |
InChI | InChI=1S/C9H9NO3S/c1-7(11)6-14-9-5-3-2-4-8(9)10(12)13/h2-5H,6H2,1H3 |
InChIKey | AGNNBHMFRWKZDG-UHFFFAOYSA-N |
Instrument Name | BRUKER AC-300 |
Molecular Weight | 211.24 |
Solvent | CDCl3; Reference=TMS; Temperature 297K |