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Trichloroacetic acid (2R,3S)-2,3-[(S)-Benzylidenedioxy]hex-5-enyl ester
SpectraBase Compound ID Gw70t7oOuCa
InChI InChI=1S/C15H15Cl3O4/c1-2-6-11-12(9-20-14(19)15(16,17)18)22-13(21-11)10-7-4-3-5-8-10/h2-5,7-8,11-13H,1,6,9H2/t11-,12+,13-/m0/s1
InChIKey QPMJQZCWPHBXMW-XQQFMLRXSA-N
Mol Weight 365.64 g/mol
Molecular Formula C15H15Cl3O4
Exact Mass 364.003592 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2M1NyI5H4C
Name Trichloroacetic acid (2R,3S)-2,3-[(S)-Benzylidenedioxy]hex-5-enyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15Cl3O4
InChI InChI=1S/C15H15Cl3O4/c1-2-6-11-12(9-20-14(19)15(16,17)18)22-13(21-11)10-7-4-3-5-8-10/h2-5,7-8,11-13H,1,6,9H2/t11-,12+,13-/m0/s1
InChIKey QPMJQZCWPHBXMW-XQQFMLRXSA-N
Molecular Weight 365.640 g/mol
SMILES [C@@]1(O[C@](COC(C(Cl)(Cl)Cl)=O)([C@@](O1)(CC=C)[H])[H])(c1ccccc1)[H]
SPLASH splash10-05r0-7879000000-b6cd4b2062f8d19df75c
Source of Spectrum SO-0-468-35
Synonyms [(2S,4R,5S)-5-allyl-2-phenyl-1,3-dioxolan-4-yl]methyl trichloroacetate
Wiley ID 1545671