| SpectraBase Compound ID | IxkitDEcVU1 |
|---|---|
| InChI | InChI=1S/C7H4N2O3.H2O/c8-4-5-3-6(9(11)12)1-2-7(5)10;/h1-3,10H;1H2 |
| InChIKey | HMIBQYFDAHJSPL-UHFFFAOYSA-N |
| Mol Weight | 182.135 g/mol |
| Molecular Formula | C7H6N2O4 |
| Exact Mass | 182.032757 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | AyhPLuDkkey |
|---|---|
| Name | 5-NITROSALICYLONITRILE, HYDRATE |
| Source of Sample | W. O. Foye & E. Feldmann, Massachusetts College of Pharmacy, Boston, Massachusetts |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H6N2O4 |
| InChI | InChI=1S/C7H4N2O3.H2O/c8-4-5-3-6(9(11)12)1-2-7(5)10;/h1-3,10H;1H2 |
| InChIKey | HMIBQYFDAHJSPL-UHFFFAOYSA-N |
| Melting Point | 160-161C |
| Molecular Weight | 182.134995 |
| Synonyms | SALICYLONITRILE, 4-NITRO-, HYDRATE |
| Technique | KBr WAFER |