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2-(7-Methyl-2-oxepanyl)acetic acid ethyl ester
SpectraBase Compound ID IXbMAgiVesr
InChI InChI=1S/C11H20O3/c1-3-13-11(12)8-10-7-5-4-6-9(2)14-10/h9-10H,3-8H2,1-2H3
InChIKey QRHHEGMBGKVUBH-UHFFFAOYSA-N
Mol Weight 200.28 g/mol
Molecular Formula C11H20O3
Exact Mass 200.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KMld6Xd3LWg
Name 2-(7-Methyl-2-oxepanyl)acetic acid ethyl ester
Alternate Name(s) 2-(7-Methyloxepan-2-yl)acetic acid ethyl ester Ethyl 2-(7-methyloxepan-2-yl)acetate Ethyl 2-(7-methyloxepan-2-yl)ethanoate
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Formula C11H20O3
InChI InChI=1S/C11H20O3/c1-3-13-11(12)8-10-7-5-4-6-9(2)14-10/h9-10H,3-8H2,1-2H3
InChIKey QRHHEGMBGKVUBH-UHFFFAOYSA-N
Molecular Weight 200.278 g/mol
SMILES C(C(=O)OCC)C1OC(C)CCCC1
SPLASH splash10-0cei-9700000000-79b90699605fb6533313
Source of Spectrum AJ-63-1908-3
Wiley ID 1197755