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3-(propionyloxy)propyl 2-(3,3-dimethylcyclohexyl)propanoate
SpectraBase Compound ID AJsSftRO5p3
InChI InChI=1S/C17H30O4/c1-5-15(18)20-10-7-11-21-16(19)13(2)14-8-6-9-17(3,4)12-14/h13-14H,5-12H2,1-4H3
InChIKey VZXNHKWRBVRUAW-UHFFFAOYSA-N
Mol Weight 298.42 g/mol
Molecular Formula C17H30O4
Exact Mass 298.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HQ6s3KesxdM
Name 3-(propionyloxy)propyl 2-(3,3-dimethylcyclohexyl)propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H30O4
InChI InChI=1S/C17H30O4/c1-5-15(18)20-10-7-11-21-16(19)13(2)14-8-6-9-17(3,4)12-14/h13-14H,5-12H2,1-4H3
InChIKey VZXNHKWRBVRUAW-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP2010
Ionization Type EI
Molecular Weight 298.423 g/mol
SMILES C(CC)(=O)OCCCOC(C(C)C1CC(CCC1)(C)C)=O
SPLASH splash10-014i-8900000000-18329741567d7d07bcd6
Sample Comments Isomer 2, dr = 1:1
Source of Spectrum JPWO2019124533A1
Wiley ID 1879765