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1-[2-(4-Fluorobenzoyloxyl)eth-1-yl]-4-[(E)-1,2-(dimethoxycarbonyl)ethen-1-yl]piperazine
SpectraBase Compound ID DO9tc88FcoQ
InChI InChI=1S/C19H23FN2O6/c1-26-17(23)13-16(19(25)27-2)22-9-7-21(8-10-22)11-12-28-18(24)14-3-5-15(20)6-4-14/h3-6,13H,7-12H2,1-2H3/b16-13+
InChIKey DKKFUHJGAFTQKB-DTQAZKPQSA-N
Mol Weight 394.4 g/mol
Molecular Formula C19H23FN2O6
Exact Mass 394.154015 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1vcS0XSAA99
Name 1-[2-(4-Fluorobenzoyloxyl)eth-1-yl]-4-[(E)-1,2-(dimethoxycarbonyl)ethen-1-yl]piperazine
Alternate Name(s) Dimethyl 2-(4-(2-((4-fluorobenzoyl)oxy)ethyl)piperazin-1-yl)maleate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23FN2O6
InChI InChI=1S/C19H23FN2O6/c1-26-17(23)13-16(19(25)27-2)22-9-7-21(8-10-22)11-12-28-18(24)14-3-5-15(20)6-4-14/h3-6,13H,7-12H2,1-2H3/b16-13+
InChIKey DKKFUHJGAFTQKB-DTQAZKPQSA-N
Literature Reference DOI 10.1039/c4ra14811h
Molecular Weight 394.399 g/mol
SMILES c1c(ccc(C(OCCN2CCN(CC2)\C(C(=O)OC)=C/C(=O)OC)=O)c1)F
SPLASH splash10-0006-1593000000-593f99749fb2167798b6
Source of Spectrum RSA-5-10768/SM-7a
Wiley ID 1760219