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1-[(E)-1,2-(Dimethoxycarbonyl)ethen-1-yl]-4-[2-(3-methylbenzoyloxyl)eth-1- yl]piperazine
SpectraBase Compound ID 7CthPhK46i6
InChI InChI=1S/C20H26N2O6/c1-15-5-4-6-16(13-15)19(24)28-12-11-21-7-9-22(10-8-21)17(20(25)27-3)14-18(23)26-2/h4-6,13-14H,7-12H2,1-3H3/b17-14+
InChIKey SJTVVOQTQFTBBX-SAPNQHFASA-N
Mol Weight 390.44 g/mol
Molecular Formula C20H26N2O6
Exact Mass 390.179087 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LfzvEFX1Hgv
Name 1-[(E)-1,2-(Dimethoxycarbonyl)ethen-1-yl]-4-[2-(3-methylbenzoyloxyl)eth-1- yl]piperazine
Alternate Name(s) Dimethyl 2-(4-(2-((3-methylbenzoyl)oxy)ethyl)piperazin-1-yl)maleate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26N2O6
InChI InChI=1S/C20H26N2O6/c1-15-5-4-6-16(13-15)19(24)28-12-11-21-7-9-22(10-8-21)17(20(25)27-3)14-18(23)26-2/h4-6,13-14H,7-12H2,1-3H3/b17-14+
InChIKey SJTVVOQTQFTBBX-SAPNQHFASA-N
Literature Reference DOI 10.1039/c4ra14811h
Molecular Weight 390.436 g/mol
SMILES C(=O)(OCCN1CCN(CC1)\C(=C\C(=O)OC)C(=O)OC)c1cc(ccc1)C
SPLASH splash10-0006-3591000000-fd016cc7e4e8581b9915
Source of Spectrum RSA-5-10768/SM-17a
Wiley ID 1760171