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Ethyl 2-(6-benzyl-4-cis-chloro-tetrahydro-2H-pyran-2-yl)acetate
SpectraBase Compound ID 7AOYl6X4NsA
InChI InChI=1S/C16H21ClO3/c1-2-19-16(18)11-15-10-13(17)9-14(20-15)8-12-6-4-3-5-7-12/h3-7,13-15H,2,8-11H2,1H3/t13-,14+,15+/m0/s1
InChIKey XOISKMYUQBFQSR-RRFJBIMHSA-N
Mol Weight 296.79 g/mol
Molecular Formula C16H21ClO3
Exact Mass 296.117922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DEjYBuwgtbn
Name Ethyl 2-(6-benzyl-4-cis-chloro-tetrahydro-2H-pyran-2-yl)acetate
Alternate Name(s) Ethyl 2-((2S,4S,6R)-6-benzyl-4-chlorotetrahydro-2H-pyran-2-yl)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21ClO3
InChI InChI=1S/C16H21ClO3/c1-2-19-16(18)11-15-10-13(17)9-14(20-15)8-12-6-4-3-5-7-12/h3-7,13-15H,2,8-11H2,1H3/t13-,14+,15+/m0/s1
InChIKey XOISKMYUQBFQSR-RRFJBIMHSA-N
Literature Reference DOI 10.1002/cjoc.201100659
Molecular Weight 296.794 g/mol
SMILES C(C[C@@]1(O[C@@](C[C@](Cl)(C1)[H])(Cc1ccccc1)[H])[H])(=O)OCC
SPLASH splash10-001i-9030000000-996b6a31372b054841b1
Source of Spectrum CJC-30-1442-2b
Wiley ID 1772721