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Grepafloxacin -CO2 TMS
SpectraBase Compound ID 3lOUzy5FgTH
InChI InChI=1S/C21H30FN3OSi/c1-14-13-23(10-11-25(14)27(3,4)5)18-12-17-20(15(2)21(18)22)19(26)8-9-24(17)16-6-7-16/h8-9,12,14,16H,6-7,10-11,13H2,1-5H3
InChIKey CBMOHWBIZKZIGP-UHFFFAOYSA-N
Mol Weight 387.57 g/mol
Molecular Formula C21H30FN3OSi
Exact Mass 387.214217 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2kWAXufdqq
Name Grepafloxacin -CO2 TMS
Classification Antibiotic
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Exact Mass 387.214217295 u
Formula C21H30N3OFSi
InChI InChI=1S/C21H30FN3OSi/c1-14-13-23(10-11-25(14)27(3,4)5)18-12-17-20(15(2)21(18)22)19(26)8-9-24(17)16-6-7-16/h8-9,12,14,16H,6-7,10-11,13H2,1-5H3
InChIKey CBMOHWBIZKZIGP-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 387.574 g/mol
Related CAS Registry Number(s) 119914-60-2
SMILES c1(c(F)c(c2C(C=CN(c2c1)C1CC1)=O)C)N1CC(N(CC1)[Si](C)(C)C)C
SPLASH splash10-001i-1139000000-6daaa3b798ec2c6a7285
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.
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_7736