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Phytone
SpectraBase Compound ID FkSJxx1nPgX
InChI InChI=1S/C18H36O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h15-17H,6-14H2,1-5H3/t16-,17-/m1/s1
InChIKey WHWDWIHXSPCOKZ-IAGOWNOFSA-N
Mol Weight 268.5 g/mol
Molecular Formula C18H36O
Exact Mass 268.276616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9eC8oajIRiF
Name Phytone
Appearance Oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 268.276615778 u
Formula C18H36O
GC Oven Program Oven temp 220-300oC
InChI InChI=1S/C18H36O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h15-17H,6-14H2,1-5H3/t16-,17-/m1/s1
InChIKey WHWDWIHXSPCOKZ-IAGOWNOFSA-N
Instrument Name JEOL JMS-T100GCV
Ionization Type EI
Literature Reference DOI 10.1002/anie.201805383
Molecular Weight 268.485 g/mol
Quality 871
SMILES CC(CCC[C@@](C)(CCC[C@@](C)(CCCC(C)=O)[H])[H])C
SPLASH splash10-0a4i-9100000000-d174c00003c7615976a4
Source of Spectrum ACI-57-SM25-3 (DOI: 10.1002/anie.201805383)
Wiley ID 1896783