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Ethyl (2Z)-1,3-Dihydro-[4-(pentafluoroethyl)-2H-1,5-benzodiazepin-2-ylidene]acetate
SpectraBase Compound ID LpO2L8sdxZZ
InChI InChI=1S/C15H13F5N2O2/c1-2-24-13(23)8-9-7-12(14(16,17)15(18,19)20)22-11-6-4-3-5-10(11)21-9/h3-6,8,21H,2,7H2,1H3/b9-8-
InChIKey STOFMUHGOHVFJI-HJWRWDBZSA-N
Mol Weight 348.27 g/mol
Molecular Formula C15H13F5N2O2
Exact Mass 348.089718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DUj31cRfUH6
Name Ethyl (2Z)-1,3-Dihydro-[4-(pentafluoroethyl)-2H-1,5-benzodiazepin-2-ylidene]acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13F5N2O2
InChI InChI=1S/C15H13F5N2O2/c1-2-24-13(23)8-9-7-12(14(16,17)15(18,19)20)22-11-6-4-3-5-10(11)21-9/h3-6,8,21H,2,7H2,1H3/b9-8-
InChIKey STOFMUHGOHVFJI-HJWRWDBZSA-N
Molecular Weight 348.273 g/mol
SMILES N1\C(CC(=Nc2c1cccc2)C(F)(C(F)(F)F)F)=C/C(OCC)=O
SPLASH splash10-0pba-0419000000-14bec85364b0103f8665
Source of Spectrum H-99-368-4c
Synonyms Ethyl (Z)-2-(4-(perfluoroethyl)-1,3-dihydro-2H-benzo[b][1,4]diazepin-2-ylidene)acetate
Wiley ID 1800089