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(4S,5R)-(TRANS)-5-N-BUTYL-4-METHYL-4,5-DIHYDRO-2(3H)-FURANONE
SpectraBase Compound ID A1AgnmQZdiK
InChI InChI=1S/C9H16O2/c1-3-4-5-8-7(2)6-9(10)11-8/h7-8H,3-6H2,1-2H3/t7-,8+/m0/s1
InChIKey WNVCMFHPRIBNCW-JGVFFNPUSA-N
Mol Weight 156.22 g/mol
Molecular Formula C9H16O2
Exact Mass 156.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1F6rh959KBT
Name .beta.-methyl-.gamma.-octalactone (Z and E)
Alternate Name(s) (3S,4R)-3-Methyl-4-octanolide (4S,5R)-5-butyl-4-methyl-2-oxolanone (4S,5R)-5-butyl-4-methyl-oxolan-2-one (4S,5R)-5-butyl-4-methyl-tetrahydrofuran-2-one (4S,5R)-5-butyl-4-methyloxolan-2-one trans-3-Methyl-4-octanolide trans-Oaklactone trans-Whiskey lactone
CAS Registry Number 99530-35-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O2
InChI InChI=1S/C9H16O2/c1-3-4-5-8-7(2)6-9(10)11-8/h7-8H,3-6H2,1-2H3/t7-,8+/m0/s1
InChIKey WNVCMFHPRIBNCW-JGVFFNPUSA-N
Molecular Weight 156.225 g/mol
SMILES C1(O[C@@]([C@](C1)(C)[H])(CCCC)[H])=O
SPLASH splash10-0006-9000000000-c7288d6de6636f3b64b2
Source of Spectrum JZ-1992-4234-0
Wiley ID 1153781