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3-Acetoxy-1,4-dibenzyl-3-(3-hydroxy-1-methylenepropyl)piperazine-2,5-dione
SpectraBase Compound ID KsRLDqbZTA1
InChI InChI=1S/C24H26N2O5/c1-18(13-14-27)24(31-19(2)28)23(30)25(15-20-9-5-3-6-10-20)17-22(29)26(24)16-21-11-7-4-8-12-21/h3-12,27H,1,13-17H2,2H3
InChIKey VULXNKNCEJBMJD-UHFFFAOYSA-N
Mol Weight 422.48 g/mol
Molecular Formula C24H26N2O5
Exact Mass 422.184172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JRUg3wJxp4I
Name 3-Acetoxy-1,4-dibenzyl-3-(3-hydroxy-1-methylenepropyl)piperazine-2,5-dione
Alternate Name(s) 1,4-Dibenzyl-2-[1-(2-hydroxyethyl)vinyl]-3,6-dioxo-2-piperazinyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H26N2O5
InChI InChI=1S/C24H26N2O5/c1-18(13-14-27)24(31-19(2)28)23(30)25(15-20-9-5-3-6-10-20)17-22(29)26(24)16-21-11-7-4-8-12-21/h3-12,27H,1,13-17H2,2H3
InChIKey VULXNKNCEJBMJD-UHFFFAOYSA-N
Molecular Weight 422.481 g/mol
SMILES OCCC(C1(N(C(=O)CN(C1=O)Cc1ccccc1)Cc1ccccc1)OC(=O)C)=C
SPLASH splash10-001i-9000000000-f90e47a208f162e207c4
Source of Spectrum I-61-527-46
Wiley ID 1378639