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Acetic acid, trichloro-, 3-[1-methyl-4-[1-oxo-3-(trimethylsilyl)-2-propenyl]-3-cyclohexen-1-yl]propyl ester, (E)-
SpectraBase Compound ID JMlgvxSzjIU
InChI InChI=1S/C18H27Cl3O3Si/c1-17(9-5-12-24-16(23)18(19,20)21)10-6-14(7-11-17)15(22)8-13-25(2,3)4/h6,8,13H,5,7,9-12H2,1-4H3/b13-8+
InChIKey OROLVEKDFVNFME-MDWZMJQESA-N
Mol Weight 425.86 g/mol
Molecular Formula C18H27Cl3O3Si
Exact Mass 424.079504 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J7in242VGdT
Name Acetic acid, trichloro-, 3-[1-methyl-4-[1-oxo-3-(trimethylsilyl)-2-propenyl]-3-cyclohexen-1-yl]propyl ester, (E)-
Alternate Name(s) (E)-3-{1'-methyl-4'-[1'-oxo-3''-(trimethylsilyl)-2''-propenyl]-3'-cyclohexenyl}propyl trichloroacetate 3-{1-methyl-4-[(2E)-3-(trimethylsilyl)-2-propenoyl]-3-cyclohexen-1-yl}propyl trichloroacetate
CAS Registry Number 117398-43-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H27Cl3O3Si
InChI InChI=1S/C18H27Cl3O3Si/c1-17(9-5-12-24-16(23)18(19,20)21)10-6-14(7-11-17)15(22)8-13-25(2,3)4/h6,8,13H,5,7,9-12H2,1-4H3/b13-8+
InChIKey OROLVEKDFVNFME-MDWZMJQESA-N
Molecular Weight 425.855 g/mol
SMILES C(C(=O)OCCCC1(CC=C(CC1)C(\C=C\[Si](C)(C)C)=O)C)(Cl)(Cl)Cl
SPLASH splash10-05fr-9010000000-7b3c9e3e6e81e7dd261c
Source of Spectrum H-71-190-1
Wiley ID 1379134