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Oxiranehexanoic acid, 3-ethyl-.beta.-oxo-, methyl ester, cis-
SpectraBase Compound ID 9dYHAplbf3e
InChI InChI=1S/C11H18O4/c1-3-9-10(15-9)6-4-5-8(12)7-11(13)14-2/h9-10H,3-7H2,1-2H3/t9-,10+/m1/s1
InChIKey HTITXWJYVMCXKH-ZJUUUORDSA-N
Mol Weight 214.26 g/mol
Molecular Formula C11H18O4
Exact Mass 214.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AqsXcycW6Oh
Name Oxiranehexanoic acid, 3-ethyl-.beta.-oxo-, methyl ester, cis-
CAS Registry Number 71203-76-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O4
InChI InChI=1S/C11H18O4/c1-3-9-10(15-9)6-4-5-8(12)7-11(13)14-2/h9-10H,3-7H2,1-2H3/t9-,10+/m1/s1
InChIKey HTITXWJYVMCXKH-ZJUUUORDSA-N
Molecular Weight 214.261 g/mol
SMILES [C@@]1(O[C@@]1(CC)[H])(CCCC(CC(=O)OC)=O)[H]
SPLASH splash10-0abd-9500000000-901c2640741fcb013995
Source of Spectrum I-57-1478-0
Synonyms cis-1-carbomethoxy-2-oxo-6,7-epoxynonane Methyl 6-[(2S,3R)-3-ethyloxiranyl]-3-oxohexanoate
Wiley ID 1213338