| SpectraBase Compound ID | 2YaoesJ3u0I |
|---|---|
| InChI | InChI=1S/C16H17N3O5S.H2O/c1-7-6-25-15-11(14(22)19(15)12(7)16(23)24)18-13(21)10(17)8-2-4-9(20)5-3-8;/h2-5,10-11,15,20H,6,17H2,1H3,(H,18,21)(H,23,24);1H2/t10-,11-,15-;/m1./s1 |
| InChIKey | NBFNMSULHIODTC-CYJZLJNKSA-N |
| Mol Weight | 381.403 g/mol |
| Molecular Formula | C16H19N3O6S |
| Exact Mass | 381.099457 g/mol |
Raman Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 1CYA9gVjzbf |
|---|---|
| Name | Cefadroxil monohydrate in kbr |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 381.099456512 u |
| Formula | C16H19N3O6S |
| InChI | InChI=1S/C16H17N3O5S.H2O/c1-7-6-25-15-11(14(22)19(15)12(7)16(23)24)18-13(21)10(17)8-2-4-9(20)5-3-8;/h2-5,10-11,15,20H,6,17H2,1H3,(H,18,21)(H,23,24);1H2/t10-,11-,15-;/m1./s1 |
| InChIKey | NBFNMSULHIODTC-CYJZLJNKSA-N |
| SMILES | N(C([C@@](C=1C=CC(=CC1)O)(N)[H])=O)[C@]1([C@@]2(N(C(C(=O)O)=C(CS2)C)C1=O)[H])[H].O |
| Spectrum/Structure Validation Score (Raman) | 0.951429 |