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Erlotinib TMS
SpectraBase Compound ID ACuljE97BSX
InChI InChI=1S/C25H31N3O4Si/c1-7-19-9-8-10-20(15-19)28(33(4,5)6)25-21-16-23(31-13-11-29-2)24(32-14-12-30-3)17-22(21)26-18-27-25/h1,8-10,15-18H,11-14H2,2-6H3
InChIKey YRNJWRUHBJPINP-UHFFFAOYSA-N
Mol Weight 465.63 g/mol
Molecular Formula C25H31N3O4Si
Exact Mass 465.208383 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ZEXtBjVzM
Name Erlotinib TMS
Classification Cytostatic
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Exact Mass 465.208383021 u
Formula C25H31N3O4Si
InChI InChI=1S/C25H31N3O4Si/c1-7-19-9-8-10-20(15-19)28(33(4,5)6)25-21-16-23(31-13-11-29-2)24(32-14-12-30-3)17-22(21)26-18-27-25/h1,8-10,15-18H,11-14H2,2-6H3
InChIKey YRNJWRUHBJPINP-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 465.625 g/mol
SMILES c1c2c(cc(OCCOC)c1OCCOC)c(ncn2)N(c1cccc(c1)C#C)[Si](C)(C)C
SPLASH splash10-0kmi-9543100000-bd3d19859fff5fe1f408
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_8168