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(1'R*,2S*)2-(Propionyloxy)ethyl 2-(3,3-dimethylcyclohexyl)propanoate
SpectraBase Compound ID FfA97V1FAm1
InChI InChI=1S/C16H28O4/c1-5-14(17)19-9-10-20-15(18)12(2)13-7-6-8-16(3,4)11-13/h12-13H,5-11H2,1-4H3/t12-,13+/m0/s1
InChIKey NXXLZUSSCXHTOE-QWHCGFSZSA-N
Mol Weight 284.4 g/mol
Molecular Formula C16H28O4
Exact Mass 284.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4RulwTn9uWX
Name (1'R*,2S*)2-(Propionyloxy)ethyl 2-(3,3-dimethylcyclohexyl)propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O4
InChI InChI=1S/C16H28O4/c1-5-14(17)19-9-10-20-15(18)12(2)13-7-6-8-16(3,4)11-13/h12-13H,5-11H2,1-4H3/t12-,13+/m0/s1
InChIKey NXXLZUSSCXHTOE-QWHCGFSZSA-N
Instrument Name Shimadzu GCMS-QP2010
Ionization Type EI
Molecular Weight 284.396 g/mol
SMILES C(OC(CC)=O)COC([C@@](C)([C@]1(CC(CCC1)(C)C)[H])[H])=O
SPLASH splash10-0udi-4900000000-64253571a3b776387f3f
Source of Spectrum JPWO2019124533A1
Wiley ID 1879772