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Diethyl 5-(tert-Butoxycarbonyloxy)-4-(cyclohex-2-enyl)isophthalate
SpectraBase Compound ID HRS7doQjarV
InChI InChI=1S/C23H30O7/c1-6-27-20(24)16-13-17(21(25)28-7-2)19(15-11-9-8-10-12-15)18(14-16)29-22(26)30-23(3,4)5/h9,11,13-15H,6-8,10,12H2,1-5H3
InChIKey XYKREGQHFLEBRE-UHFFFAOYSA-N
Mol Weight 418.49 g/mol
Molecular Formula C23H30O7
Exact Mass 418.199153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FTa6qZMM7iK
Name Diethyl 5-(tert-Butoxycarbonyloxy)-4-(cyclohex-2-enyl)isophthalate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H30O7
InChI InChI=1S/C23H30O7/c1-6-27-20(24)16-13-17(21(25)28-7-2)19(15-11-9-8-10-12-15)18(14-16)29-22(26)30-23(3,4)5/h9,11,13-15H,6-8,10,12H2,1-5H3
InChIKey XYKREGQHFLEBRE-UHFFFAOYSA-N
Molecular Weight 418.486 g/mol
SMILES c1(c(c(OC(OC(C)(C)C)=O)cc(c1)C(=O)OCC)C1C=CCCC1)C(=O)OCC
SPLASH splash10-00di-5193000000-d4223e3fa669f2411129
Source of Spectrum U1-2010-1789-24
Wiley ID 1663617