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(S)-3-hydroxypentadecan-4-one
SpectraBase Compound ID 7Ymg0Ymqjsg
InChI InChI=1S/C15H30O2/c1-3-5-6-7-8-9-10-11-12-13-15(17)14(16)4-2/h14,16H,3-13H2,1-2H3/t14-/m0/s1
InChIKey BQRGHMCHOJLOLX-AWEZNQCLSA-N
Mol Weight 242.4 g/mol
Molecular Formula C15H30O2
Exact Mass 242.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AAmt5ZgNQzL
Name (S)-3-hydroxypentadecan-4-one
Appearance Colorless oil
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H30O2
GC Oven Program Oven temp 300oC, Splitless injector
InChI InChI=1S/C15H30O2/c1-3-5-6-7-8-9-10-11-12-13-15(17)14(16)4-2/h14,16H,3-13H2,1-2H3/t14-/m0/s1
InChIKey BQRGHMCHOJLOLX-AWEZNQCLSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1021/acs.jnatprod.0c00054
Molecular Weight 242.403 g/mol
Optical Rotation [a]D25 = 62.3 (c = 0.770, Chloroform)
SMILES O[C@](C(CCCCCCCCCCC)=O)(CC)[H]
SPLASH splash10-0a4i-9200000000-f00dcfceb588e5424e66
Source of Spectrum G4-83-1878-2, C15-AHK
Wiley ID 1876884