For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1,4-Cyclohexanedicarboxylic acid, 1,4-diethyl-2,5-dioxo-, diethyl ester, trans-
SpectraBase Compound ID 7wcsu5ClYzR
InChI InChI=1S/C16H24O6/c1-5-15(13(19)21-7-3)9-12(18)16(6-2,10-11(15)17)14(20)22-8-4/h5-10H2,1-4H3/t15-,16+
InChIKey JXAQXHAHMVLIGI-IYBDPMFKSA-N
Mol Weight 312.36 g/mol
Molecular Formula C16H24O6
Exact Mass 312.157288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID EsKFL3632OF
Name 1,4-Cyclohexanedicarboxylic acid, 1,4-diethyl-2,5-dioxo-, diethyl ester, trans-
Alternate Name(s) 2,5-bis(ethoxycarbonyl)-2,5-diethylcyclohexane-1,4-dione Diethyl (1R,4S)-1,4-diethyl-2,5-dioxo-1,4-cyclohexanedicarboxylate
CAS Registry Number 62554-93-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24O6
InChI InChI=1S/C16H24O6/c1-5-15(13(19)21-7-3)9-12(18)16(6-2,10-11(15)17)14(20)22-8-4/h5-10H2,1-4H3/t15-,16+
InChIKey JXAQXHAHMVLIGI-IYBDPMFKSA-N
Molecular Weight 312.362 g/mol
SMILES [C@]1(C(C[C@@](C(C1)=O)(C(=O)OCC)CC)=O)(C(=O)OCC)CC
SPLASH splash10-054x-4920000000-40444c34536c1b5acc3e
Source of Spectrum KC-1979-3097-0
Wiley ID 1313136