| SpectraBase Compound ID | AwUagnOy0zu |
|---|---|
| InChI | InChI=1S/C22H22N6O7S2.5H2O/c1-22(2,20(33)34)35-26-13(12-10-37-21(23)24-12)16(29)25-14-17(30)28-15(19(31)32)11(9-36-18(14)28)8-27-6-4-3-5-7-27;;;;;/h3-7,10,14,18H,8-9H2,1-2H3,(H4-,23,24,25,29,31,32,33,34);5*1H2/b26-13-;;;;; |
| InChIKey | NMVPEQXCMGEDNH-DZIBSCEJSA-N |
| Mol Weight | 636.648 g/mol |
| Molecular Formula | C22H32N6O12S2 |
| Exact Mass | 636.151963 g/mol |
Attenuated Total Reflectance Infrared (ATR-IR) Spectrum
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| SpectraBase Spectrum ID | Ckggp7lKYxn |
|---|---|
| Name | Ceftazidime pentahydrate |
| Source of Sample | Cayman Chemical Company |
| Catalog Number | 14828 |
| Lot Number | 0450791-15 |
| Accessory | DurasamplIR II |
| Apodization Function | Triangular |
| CAS Registry Number | 78439-06-2 |
| Copyright | Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H32N6O12S2 |
| IUPAC Name | 1-[[(6R,7R)-7-[[(2Z)-(2-Amino-4-thiazolyl)[(1-carboxy-1-methylethoxy)imino]acetyl]amino]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl]-pyridinium, pentahydrate |
| InChI | InChI=1S/C22H22N6O7S2.5H2O/c1-22(2,20(33)34)35-26-13(12-10-37-21(23)24-12)16(29)25-14-17(30)28-15(19(31)32)11(9-36-18(14)28)8-27-6-4-3-5-7-27;;;;;/h3-7,10,14,18H,8-9H2,1-2H3,(H4-,23,24,25,29,31,32,33,34);5*1H2/b26-13-;;;;; |
| InChIKey | NMVPEQXCMGEDNH-DZIBSCEJSA-N |
| Instrument Name | Bio-Rad FTS |
| SMILES | N(C1C2SC\C(=C/(N2C1=O)C([O-])=O)C[n+]1ccccc1)C(\C(=N/OC(C(O)=O)(C)C)c1nc(sc1)N)=O.O.O.O.O.O |
| Scan Speed (number) | 5 |
| Source of Spectrum | Forensic Spectral Research |
| Synonyms | Starcef 1 |
| Technique | ATR-Neat |