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(S)-N-(3-Oxo-octanoyl)homoserine lactone
SpectraBase Compound ID FUuHgJs141f
InChI InChI=1S/C12H19NO4/c1-2-3-4-5-9(14)8-11(15)13-10-6-7-17-12(10)16/h10H,2-8H2,1H3,(H,13,15)/t10-/m0/s1
InChIKey FXCMGCFNLNFLSH-JTQLQIEISA-N
Mol Weight 241.29 g/mol
Molecular Formula C12H19NO4
Exact Mass 241.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 99vSfGdmmwM
Name (S)-N-(3-Oxo-octanoyl)homoserine lactone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H19NO4
InChI InChI=1S/C12H19NO4/c1-2-3-4-5-9(14)8-11(15)13-10-6-7-17-12(10)16/h10H,2-8H2,1H3,(H,13,15)/t10-/m0/s1
InChIKey FXCMGCFNLNFLSH-JTQLQIEISA-N
Instrument Name Therm Finnigan Focus-DSQ II
Ionization Type EI
Literature Reference DOI 10.1021/acs.jnatprod.5b01075
Molecular Weight 241.287 g/mol
Optical Rotation [a]D20 = -10 (c = 1.0, EtOAc)
SMILES N(C(CC(CCCCC)=O)=O)[C@]1(CCOC1=O)[H]
SPLASH splash10-0a4i-9330000000-feb23ec898553c616d1e
Source of Spectrum G4-79-1320-1320-1
Wiley ID 1849331