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1-Acetonyl-2-oxabicyclo[3.2.0]heptane-7-carboxylic Acid
SpectraBase Compound ID qPv4bsIxic
InChI InChI=1S/C10H14O4/c1-6(11)5-10-7(2-3-14-10)4-8(10)9(12)13/h7-8H,2-5H2,1H3,(H,12,13)
InChIKey JYVXSHOCHUPRGI-UHFFFAOYSA-N
Mol Weight 198.22 g/mol
Molecular Formula C10H14O4
Exact Mass 198.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HXVo5d0Buwq
Name 1-Acetonyl-2-oxabicyclo[3.2.0]heptane-7-carboxylic Acid
Comments Less than 3 mono-isotopic peaks
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Formula C10H14O4
InChI InChI=1S/C10H14O4/c1-6(11)5-10-7(2-3-14-10)4-8(10)9(12)13/h7-8H,2-5H2,1H3,(H,12,13)
InChIKey JYVXSHOCHUPRGI-UHFFFAOYSA-N
Molecular Weight 198.218 g/mol
SMILES OC(C1C2(C(C1)CCO2)CC(=O)C)=O
SPLASH splash10-004i-0900000000-8884909cdb70d2954dba
Source of Spectrum Y-28-747-7
Synonyms 1-(2-oxopropyl)-2-oxabicyclo[3.2.0]heptane-7-carboxylic acid
Wiley ID 1195268