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l-threo-.alpha.-d-Galacto-octopyranoside, methyl 7-chloro-6,7,8-trideoxy-6-[[(1-methyl-4-propyl-2-pyrrolidinyl)carbonyl]amino]-1-thio-, (2S-trans)-
SpectraBase Compound ID 6GUMuDFULLh
InChI InChI=1S/C18H33ClN2O5S/c1-5-6-10-7-11(21(3)8-10)17(25)20-12(9(2)19)16-14(23)13(22)15(24)18(26-16)27-4/h9-16,18,22-24H,5-8H2,1-4H3,(H,20,25)
InChIKey KDLRVYVGXIQJDK-UHFFFAOYSA-N
Mol Weight 425.0 g/mol
Molecular Formula C18H33ClN2O5S
Exact Mass 424.179871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9MIKX8xDGxC
Name Clindamycin
CAS Registry Number 18323-44-9
Classification Antibiotic
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 424.179871040 u
Formula C18H33ClN2O5S
InChI InChI=1S/C18H33ClN2O5S/c1-5-6-10-7-11(21(3)8-10)17(25)20-12(9(2)19)16-14(23)13(22)15(24)18(26-16)27-4/h9-16,18,22-24H,5-8H2,1-4H3,(H,20,25)
InChIKey KDLRVYVGXIQJDK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 424.984 g/mol
SMILES C1(OC(SC)C(C(C1O)O)O)C(NC(C1N(CC(C1)CCC)C)=O)C(Cl)C
SPLASH splash10-004i-2900000000-9f9d06ce65c19ec63cc3
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: G P U
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_4481