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1-[(1S)-1-(3-bromopropoxy)-3,3,3-trichloro-propyl]-4-methoxy-benzene
SpectraBase Compound ID B6OlUeRsxj
InChI InChI=1S/C13H16BrCl3O2/c1-18-11-5-3-10(4-6-11)12(9-13(15,16)17)19-8-2-7-14/h3-6,12H,2,7-9H2,1H3/t12-/m0/s1
InChIKey FCTARGIVEAVHQL-LBPRGKRZSA-N
Mol Weight 390.53 g/mol
Molecular Formula C13H16BrCl3O2
Exact Mass 387.939926 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AMYdcjB73sF
Name 1-[(1S)-1-(3-bromopropoxy)-3,3,3-trichloro-propyl]-4-methoxy-benzene
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16BrCl3O2
InChI InChI=1S/C13H16BrCl3O2/c1-18-11-5-3-10(4-6-11)12(9-13(15,16)17)19-8-2-7-14/h3-6,12H,2,7-9H2,1H3/t12-/m0/s1
InChIKey FCTARGIVEAVHQL-LBPRGKRZSA-N
Instrument Name LRMS
Ionization Type EI
Molecular Weight 390.532 g/mol
SMILES c1cc(ccc1OC)[C@@](OCCCBr)(CC(Cl)(Cl)Cl)[H]
SPLASH splash10-052r-0940000000-241d8ff8d7ac2d519f93
Source of Spectrum CN112778068A
Wiley ID 1879850