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5-Ethyl-1-hydroxymethyl-3-oxabicyclo[4.3.0]non-5-en-4-one
SpectraBase Compound ID FomlnbDx6lP
InChI InChI=1S/C11H16O3/c1-2-8-9-4-3-5-11(9,6-12)7-14-10(8)13/h12H,2-7H2,1H3
InChIKey CUDKKLKUTMDELK-UHFFFAOYSA-N
Mol Weight 196.25 g/mol
Molecular Formula C11H16O3
Exact Mass 196.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8utcpmvY2yU
Name 5-ethyl-1-hydroxymethyl-3-oxabicyclo[4.3.0]non-5-en-4-one
CAS Registry Number 129661-35-4
Comments Less than 3 mono-isotopic peaks
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Formula C11H16O3
InChI InChI=1S/C11H16O3/c1-2-8-9-4-3-5-11(9,6-12)7-14-10(8)13/h12H,2-7H2,1H3
InChIKey CUDKKLKUTMDELK-UHFFFAOYSA-N
Molecular Weight 196.246 g/mol
SMILES OCC12C(=C(C(=O)OC2)CC)CCC1
SPLASH splash10-014i-0900000000-dd33b5ddf710fce9a977
Source of Spectrum KC-1991-1554-26
Synonyms Cyclopenta[c]pyran-3(1H)-one, 4-ethyl-5,6,7,7a-tetrahydro-7a-(hydroxymethyl)- 4-ethyl-7a-(hydroxymethyl)-5,6,7,7a-tetrahydrocyclopenta[c]pyran-3(1H)-one
Wiley ID 1193216