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(10S)-10-pentyloxecan-2-one
SpectraBase Compound ID 6hPBkAH4nCC
InChI InChI=1S/C14H26O2/c1-2-3-7-10-13-11-8-5-4-6-9-12-14(15)16-13/h13H,2-12H2,1H3/t13-/m0/s1
InChIKey QWMRBWAQGBBBSB-ZDUSSCGKSA-N
Mol Weight 226.36 g/mol
Molecular Formula C14H26O2
Exact Mass 226.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IYxTGtUvPyi
Name (10S)-10-pentyloxecan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H26O2
InChI InChI=1S/C14H26O2/c1-2-3-7-10-13-11-8-5-4-6-9-12-14(15)16-13/h13H,2-12H2,1H3/t13-/m0/s1
InChIKey QWMRBWAQGBBBSB-ZDUSSCGKSA-N
Instrument Name Thermo Scientific TRACE 1310- ISQ LT
Ionization Type EI
Literature Reference DOI 10.1021/acs.jnatprod.8b00632
Molecular Weight 226.360 g/mol
SMILES C1(O[C@](CCCCCCC1)(CCCCC)[H])=O
SPLASH splash10-05ne-9100000000-1af95a536cfc665e2834
Source of Spectrum G4-81-2268-Figure 2-C
Wiley ID 1870173