| SpectraBase Compound ID | 24eXQyZ0J5h |
|---|---|
| InChI | InChI=1S/C38H72N2O12/c1-15-27-38(10,46)31(42)24(6)40(13)19-20(2)17-36(8,45)33(52-35-29(41)26(39(11)12)16-21(3)48-35)22(4)30(23(5)34(44)50-27)51-28-18-37(9,47-14)32(43)25(7)49-28/h20-33,35,41-43,45-46H,15-19H2,1-14H3/t20-,21-,22+,23-,24-,25+,26+,27-,28+,29-,30+,31-,32+,33-,35+,36-,37-,38-/m1/s1 |
| InChIKey | MQTOSJVFKKJCRP-BICOPXKESA-N |
| Mol Weight | 749.0 g/mol |
| Molecular Formula | C38H72N2O12 |
| Exact Mass | 748.508526 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | E4cRH6RERPb |
|---|---|
| Name | Azithromycin |
| Source of Sample | Sigma-Aldrich Company LLC |
| Catalog Number | 75199 |
| Lot Number | 446421/1 |
| Apodization Function | Triangular |
| CAS Registry Number | 83905-01-5 |
| Copyright | Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C38H72N2O12 |
| InChI | InChI=1S/C38H72N2O12/c1-15-27-38(10,46)31(42)24(6)40(13)19-20(2)17-36(8,45)33(52-35-29(41)26(39(11)12)16-21(3)48-35)22(4)30(23(5)34(44)50-27)51-28-18-37(9,47-14)32(43)25(7)49-28/h20-33,35,41-43,45-46H,15-19H2,1-14H3/t20-,21-,22+,23-,24-,25+,26+,27-,28+,29-,30+,31-,32+,33-,35+,36-,37-,38-/m1/s1 |
| InChIKey | MQTOSJVFKKJCRP-BICOPXKESA-N |
| Instrument Name | Bio-Rad FTS |
| SMILES | O[C@@]1([C@](OC([C@@]([C@]([C@@]([C@@](O[C@@]2(O[C@@](C[C@@]([C@]2(O)[H])(N(C)C)[H])(C)[H])[H])([C@@](C[C@](CN([C@@]([C@]1(O)[H])(C)[H])C)(C)[H])(O)C)[H])(C)[H])(O[C@@]1(O[C@]([C@@]([C@](C1)(C)OC)(O)[H])(C)[H])[H])[H])(C)[H])=O)(CC)[H])C |
| Scan Speed (number) | 5 |
| Source of Spectrum | Forensic Spectral Research |
| Technique | KBr0 |