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1-[(1S)-1-butoxy-3,3,3-trichloro-propyl]-4-methoxy-benzene
SpectraBase Compound ID 26ozlJOg1kc
InChI InChI=1S/C14H19Cl3O2/c1-3-4-9-19-13(10-14(15,16)17)11-5-7-12(18-2)8-6-11/h5-8,13H,3-4,9-10H2,1-2H3/t13-/m0/s1
InChIKey KIBPYZYFSVIRJA-ZDUSSCGKSA-N
Mol Weight 325.66 g/mol
Molecular Formula C14H19Cl3O2
Exact Mass 324.045063 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HKTuLgcQboS
Name 1-[(1S)-1-butoxy-3,3,3-trichloro-propyl]-4-methoxy-benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H19Cl3O2
InChI InChI=1S/C14H19Cl3O2/c1-3-4-9-19-13(10-14(15,16)17)11-5-7-12(18-2)8-6-11/h5-8,13H,3-4,9-10H2,1-2H3/t13-/m0/s1
InChIKey KIBPYZYFSVIRJA-ZDUSSCGKSA-N
Instrument Name LRMS
Ionization Type EI
Molecular Weight 325.663 g/mol
SMILES c1cc(ccc1OC)[C@@](OCCCC)(CC(Cl)(Cl)Cl)[H]
SPLASH splash10-000l-0900000000-180b8e5a99e5daed70f8
Source of Spectrum CN112778068A
Wiley ID 1879846