SpectraBase Compound ID | FBlcBvRVru2 |
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InChI | InChI=1S/C13H11NO3S/c1-17-13-9-11(7-8-12(13)14(15)16)18-10-5-3-2-4-6-10/h2-9H,1H3 |
InChIKey | VWCAJEDJASDCEU-UHFFFAOYSA-N |
Mol Weight | 261.29 g/mol |
Molecular Formula | C13H11NO3S |
Exact Mass | 261.045964 g/mol |
SpectraBase Spectrum ID | GzWGgZkyFUG |
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Name | 2-NITRO-5-(PHENYLTHIO)ANISOLE |
Source of Sample | Maybridge Chemical Company Ltd., North Cornwall, England |
Copyright | Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C13H11NO3S |
InChI | InChI=1S/C13H11NO3S/c1-17-13-9-11(7-8-12(13)14(15)16)18-10-5-3-2-4-6-10/h2-9H,1H3 |
InChIKey | VWCAJEDJASDCEU-UHFFFAOYSA-N |
Instrument Name | BRUKER AC-300 |
Melting Point | 109-110C |
Molecular Weight | 261.30 |
Solvent | CDCl3; Reference=TMS; Temperature 297K |