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Gefitinib TMS
SpectraBase Compound ID B2kPXRF2LRf
InChI InChI=1S/C25H32ClFN4O3Si/c1-32-23-16-22-19(15-24(23)34-11-5-8-30-9-12-33-13-10-30)25(29-17-28-22)31(35(2,3)4)18-6-7-21(27)20(26)14-18/h6-7,14-17H,5,8-13H2,1-4H3
InChIKey SYCODIIWVYXZRA-UHFFFAOYSA-N
Mol Weight 519.1 g/mol
Molecular Formula C25H32ClFN4O3Si
Exact Mass 518.191623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2giI13zbyy
Name Gefitinib TMS
Classification Cytostatic
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Exact Mass 518.191623301 u
Formula C25H32N4O3ClFSi
InChI InChI=1S/C25H32ClFN4O3Si/c1-32-23-16-22-19(15-24(23)34-11-5-8-30-9-12-33-13-10-30)25(29-17-28-22)31(35(2,3)4)18-6-7-21(27)20(26)14-18/h6-7,14-17H,5,8-13H2,1-4H3
InChIKey SYCODIIWVYXZRA-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 519.092 g/mol
SMILES c1c2c(ncnc2cc(c1OCCCN1CCOCC1)OC)N(c1ccc(c(c1)Cl)F)[Si](C)(C)C
SPLASH splash10-0ufr-5912000000-45463118e8dc29053890
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_8448