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1-(((1-Bromo-5-(difluoromethoxy)pentan-3-yl)oxy)methyl)-4-chlorobenzene
SpectraBase Compound ID 1h8KtWUeTjA
InChI InChI=1S/C13H16BrClF2O2/c14-7-5-12(6-8-18-13(16)17)19-9-10-1-3-11(15)4-2-10/h1-4,12-13H,5-9H2
InChIKey XBGJDZVWHSNMOK-UHFFFAOYSA-N
Mol Weight 357.62 g/mol
Molecular Formula C13H16BrClF2O2
Exact Mass 355.999027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 90wBL5uAvvv
Name 1-(((1-Bromo-5-(difluoromethoxy)pentan-3-yl)oxy)methyl)-4-chlorobenzene
Appearance Colorless oil
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Exact Mass 355.999026779 u
Formula C13H16BrClF2O2
InChI InChI=1S/C13H16BrClF2O2/c14-7-5-12(6-8-18-13(16)17)19-9-10-1-3-11(15)4-2-10/h1-4,12-13H,5-9H2
InChIKey XBGJDZVWHSNMOK-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.202103428
Molecular Weight 357.623 g/mol
Quality 8
Reported Formula C13H16BrClF2O2
SMILES C(Br)CC(CCOC(F)F)OCC1=CC=C(C=C1)Cl
SPLASH splash10-004i-0900000000-c2842c2fb9c5320bc86d
Source of Spectrum QE-27-SM26-2l (DOI: 10.1002/chem.202103428)
Wiley ID 1904305