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1-methoxy-4-[(1S)-3,3,3-trichloro-1-dodecoxy-propyl]benzene
SpectraBase Compound ID DS4z7wqD4LX
InChI InChI=1S/C22H35Cl3O2/c1-3-4-5-6-7-8-9-10-11-12-17-27-21(18-22(23,24)25)19-13-15-20(26-2)16-14-19/h13-16,21H,3-12,17-18H2,1-2H3/t21-/m0/s1
InChIKey NJOMMWYYKAGQRS-NRFANRHFSA-N
Mol Weight 437.9 g/mol
Molecular Formula C22H35Cl3O2
Exact Mass 436.170263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5NfjpqZumqN
Name 1-methoxy-4-[(1S)-3,3,3-trichloro-1-dodecoxy-propyl]benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H35Cl3O2
InChI InChI=1S/C22H35Cl3O2/c1-3-4-5-6-7-8-9-10-11-12-17-27-21(18-22(23,24)25)19-13-15-20(26-2)16-14-19/h13-16,21H,3-12,17-18H2,1-2H3/t21-/m0/s1
InChIKey NJOMMWYYKAGQRS-NRFANRHFSA-N
Instrument Name LRMS
Ionization Type EI
Molecular Weight 437.879 g/mol
SMILES c1cc(ccc1OC)[C@@](OCCCCCCCCCCCC)(CC(Cl)(Cl)Cl)[H]
SPLASH splash10-052r-0904000000-83577a4f4225b3ea40f6
Source of Spectrum CN112778068A
Wiley ID 1879847