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5-Heptyl-4-methyl-2-oxolanone
SpectraBase Compound ID 9U0QWH5iyYO
InChI InChI=1S/C12H22O2/c1-3-4-5-6-7-8-11-10(2)9-12(13)14-11/h10-11H,3-9H2,1-2H3
InChIKey OGRZZHTVLPTHNR-UHFFFAOYSA-N
Mol Weight 198.31 g/mol
Molecular Formula C12H22O2
Exact Mass 198.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KY8OxV46DcY
Name 5-Heptyl-4-methyl-2-oxolanone
CAS Registry Number 148806-10-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O2
InChI InChI=1S/C12H22O2/c1-3-4-5-6-7-8-11-10(2)9-12(13)14-11/h10-11H,3-9H2,1-2H3
InChIKey OGRZZHTVLPTHNR-UHFFFAOYSA-N
Molecular Weight 198.306 g/mol
SMILES C1(C(OC(C1)=O)CCCCCCC)C
SPLASH splash10-0007-9100000000-a7aa7f203dd7fe2037be
Source of Spectrum NP-4-114-0
Synonyms 5-Heptyl-4-methyldihydro-2(3H)-furanone 5-Heptyl-4-methyl-oxolan-2-one cis-4-Hydroxy-3-methylundecanoic acid lactone trans-4-Hydroxy-3-methylundecanoic acid lactone 5-Heptyl-4-methyl-tetrahydrofuran-2-one 5-Heptyl-4-methyloxolan-2-one
Wiley ID 1103451