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(4S,5R)-4-methyl-5-pentyl-2-oxolanone
SpectraBase Compound ID EG1rPcOmfbg
InChI InChI=1S/C10H18O2/c1-3-4-5-6-9-8(2)7-10(11)12-9/h8-9H,3-7H2,1-2H3/t8-,9+/m0/s1
InChIKey LOQFOBUZYRBURV-DTWKUNHWSA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5xjtmB92sej
Name (4S,5R)-4-methyl-5-pentyl-2-oxolanone
CAS Registry Number 114485-30-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-3-4-5-6-9-8(2)7-10(11)12-9/h8-9H,3-7H2,1-2H3/t8-,9+/m0/s1
InChIKey LOQFOBUZYRBURV-DTWKUNHWSA-N
Molecular Weight 170.252 g/mol
SMILES C1(O[C@@]([C@](C1)(C)[H])(CCCCC)[H])=O
SPLASH splash10-0002-9100000000-5f4762deb9265d5e1592
Source of Spectrum F-43-4504-3
Synonyms (4S,5R)-4-methyl-5-pentyl-oxolan-2-one (4S,5R)-4-methyl-5-pentyl-tetrahydrofuran-2-one (4S,5R)-5-amyl-4-methyl-tetrahydrofuran-2-one 4-Methyl-5-pentyl-oxolan-2-one
Wiley ID 1167149