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2-Acetyl-3,3-bis(trifluoromethyl)-2-azabicyclo[2.2.1]hept-5-ene
SpectraBase Compound ID Bhz23Sz1O88
InChI InChI=1S/C10H9F6NO/c1-5(18)17-7-3-2-6(4-7)8(17,9(11,12)13)10(14,15)16/h2-3,6-7H,4H2,1H3
InChIKey SIERWPPSKUBEJN-UHFFFAOYSA-N
Mol Weight 273.18 g/mol
Molecular Formula C10H9F6NO
Exact Mass 273.058833 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IrefzXj97iQ
Name 2-Acetyl-3,3-bis(trifluoromethyl)-2-azabicyclo[2.2.1]hept-5-ene
Alternate Name(s) 1-(3,3-Bis-trifluoromethyl-2-aza-bicyclo[2.2.1]hept-5-en-2-yl)-ethanone 1-[2,2-bis(trifluoromethyl)-3-azabicyclo[2.2.1]hept-5-en-3-yl]ethanone
CAS Registry Number 81319-55-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9F6NO
InChI InChI=1S/C10H9F6NO/c1-5(18)17-7-3-2-6(4-7)8(17,9(11,12)13)10(14,15)16/h2-3,6-7H,4H2,1H3
InChIKey SIERWPPSKUBEJN-UHFFFAOYSA-N
Molecular Weight 273.178 g/mol
SMILES C1(N(C2CC1C=C2)C(=O)C)(C(F)(F)F)C(F)(F)F
SPLASH splash10-0006-9200000000-480c5aff2b59d9800f99
Wiley ID 1459382