1-(1,3-benzodioxol-5-ylmethyl)-4-[(2E)-3-(3-nitrophenyl)-2-propenoyl]piperazine

SpectraBase Compound ID	E9KnmGNrexr
InChI	InChI=1S/C21H21N3O5/c25-21(7-5-16-2-1-3-18(12-16)24(26)27)23-10-8-22(9-11-23)14-17-4-6-19-20(13-17)29-15-28-19/h1-7,12-13H,8-11,14-15H2/b7-5+
InChIKey	NIYUNTJZZISBOG-FNORWQNLSA-N Google Search
Mol Weight	395.42 g/mol
Molecular Formula	C21H21N3O5
Exact Mass	395.148121 g/mol

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SpectraBase Spectrum ID	E6qq2o7yy4V
Name	1-(1,3-benzodioxol-5-ylmethyl)-4-[(2E)-3-(3-nitrophenyl)-2-propenoyl]piperazine
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C21H21N3O5/c25-21(7-5-16-2-1-3-18(12-16)24(26)27)23-10-8-22(9-11-23)14-17-4-6-19-20(13-17)29-15-28-19/h1-7,12-13H,8-11,14-15H2/b7-5+
InChIKey	NIYUNTJZZISBOG-FNORWQNLSA-N
NMR Offset	14.9921
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_6134
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: 121412; Labnumber: SERK1-22025; VK_ID: VK-006137
Synonyms	1-(1,3-benzodioxol-5-ylmethyl)-4-[3-(3-nitrophenyl)-2-propenoyl]piperazine
Temperature	308 °C