SpectraBase Spectrum ID |
Ay27pXknFiJ |
Name |
Clindamycin 3AC |
Classification |
Antibiotic |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
550.211565090 u |
Formula |
C24H39ClN2O8S |
InChI |
InChI=1S/C24H39ClN2O8S/c1-8-9-16-10-17(27(6)11-16)23(31)26-18(12(2)25)19-20(32-13(3)28)21(33-14(4)29)22(34-15(5)30)24(35-19)36-7/h12,16-22,24H,8-11H2,1-7H3,(H,26,31) |
InChIKey |
UPDAHNDTZSNKSX-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
551.095 g/mol |
SMILES |
C1(C(C(C(OC(=O)C)C(O1)SC)OC(=O)C)OC(=O)C)C(NC(C1N(CC(C1)CCC)C)=O)C(Cl)C |
SPLASH |
splash10-016r-6811910000-f9c2cc5050f4fd3e9e4d |
Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
Sample Preparation Procedure |
Detected: U+UHYAC |
Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
Technique |
GC/MS |
Wiley ID |
MMPW6e_4479 |