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Cyclohexanecarboxylic acid, 1-chloro-2-(chloromethyl)-, ethyl ester, trans-(.+-.)-
SpectraBase Compound ID FCmhvtRO0bl
InChI InChI=1S/C10H16Cl2O2/c1-2-14-9(13)10(12)6-4-3-5-8(10)7-11/h8H,2-7H2,1H3/t8-,10-/m0/s1
InChIKey YOEADLLGTSCCNX-WPRPVWTQSA-N
Mol Weight 239.14 g/mol
Molecular Formula C10H16Cl2O2
Exact Mass 238.052735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8BYc18IFBhl
Name Cyclohexanecarboxylic acid, 1-chloro-2-(chloromethyl)-, ethyl ester, trans-(.+-.)-
Alternate Name(s) Ethyl (1S,2S)-1-chloro-2-(chloromethyl)cyclohexanecarboxylate Ethyl trans-1-chloro-2-(chloromehyl)cyclohexane-1-carboxylate
CAS Registry Number 115119-49-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16Cl2O2
InChI InChI=1S/C10H16Cl2O2/c1-2-14-9(13)10(12)6-4-3-5-8(10)7-11/h8H,2-7H2,1H3/t8-,10-/m0/s1
InChIKey YOEADLLGTSCCNX-WPRPVWTQSA-N
Molecular Weight 239.142 g/mol
SMILES [C@@]1(C(=O)OCC)([C@](CCl)(CCCC1)[H])Cl
SPLASH splash10-004l-9410000000-9cd864bbd86adf39a3ab
Source of Spectrum C-110-5540-20
Wiley ID 1240079