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(R,E)-4-Bromo-1,1,1-trifluorodec-2-ene
SpectraBase Compound ID 3GyTekz0ruI
InChI InChI=1S/C10H16BrF3/c1-2-3-4-5-6-9(11)7-8-10(12,13)14/h7-9H,2-6H2,1H3/b8-7+/t9-/m1/s1
InChIKey ZBMNTPFOWYLBCI-FCZSHJHJSA-N
Mol Weight 273.14 g/mol
Molecular Formula C10H16BrF3
Exact Mass 272.038748 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Aj1OC885xbQ
Name (R,E)-4-Bromo-1,1,1-trifluorodec-2-ene
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 272.038748004 u
Formula C10H16BrF3
InChI InChI=1S/C10H16BrF3/c1-2-3-4-5-6-9(11)7-8-10(12,13)14/h7-9H,2-6H2,1H3/b8-7+/t9-/m1/s1
InChIKey ZBMNTPFOWYLBCI-FCZSHJHJSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/anie.202210509
Molecular Weight 273.137 g/mol
Optical Rotation [a]D25.7 = -1.8 (c = 0.1, CHCl3)
Quality 130
SMILES [C@@](Br)(\C=C\C(F)(F)F)(CCCCCC)[H]
SPLASH splash10-0k96-9600000000-544367df822086fcc5cd
Sample Comments 96% ee
Source of Spectrum ACI-61-SM33-7a (DOI: 10.1002/anie.202210509)
Wiley ID 1899613