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Letrozole

View entire compound with spectra: 2 NMR, 1 FTIR, 1 Raman, and 5 MS (GC)

Letrozole
SpectraBase Compound ID EMS4ybbwla9
InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H
InChIKey HPJKCIUCZWXJDR-UHFFFAOYSA-N
Mol Weight 285.31 g/mol
Molecular Formula C17H11N5
Exact Mass 285.101445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FYejNuFBpup
Name Letrozole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H11N5
InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H
InChIKey HPJKCIUCZWXJDR-UHFFFAOYSA-N
Molecular Weight 285.310 g/mol
SMILES C([n]1ncnc1)(c1ccc(cc1)C#N)c1ccc(cc1)C#N
SPLASH splash10-014i-2970000000-e0cec3eeaf107fe78bf2
Source of Spectrum SWG-33-552-0
Synonyms Femara 4,4'-((1H-1,2,4-triazol-1-yl)methylene)dibenzonitrile
Wiley ID 1808867