4-[(2E)-3-(1,3-benzodioxol-5-yl)-2-propenoyl]-1-methyl-5,6,7,8-tetrahydro-3(2H)-isoquinolinone

SpectraBase Compound ID	5LQqXv5UgJM
InChI	InChI=1S/C20H19NO4/c1-12-14-4-2-3-5-15(14)19(20(23)21-12)16(22)8-6-13-7-9-17-18(10-13)25-11-24-17/h6-10H,2-5,11H2,1H3,(H,21,23)/b8-6+
InChIKey	VHKMMKMHQCRLHD-SOFGYWHQSA-N Google Search
Mol Weight	337.38 g/mol
Molecular Formula	C20H19NO4
Exact Mass	337.131408 g/mol

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SpectraBase Spectrum ID	3A9Qo3KodVV
Name	4-[(2E)-3-(1,3-benzodioxol-5-yl)-2-propenoyl]-1-methyl-5,6,7,8-tetrahydro-3(2H)-isoquinolinone
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C20H19NO4/c1-12-14-4-2-3-5-15(14)19(20(23)21-12)16(22)8-6-13-7-9-17-18(10-13)25-11-24-17/h6-10H,2-5,11H2,1H3,(H,21,23)/b8-6+
InChIKey	VHKMMKMHQCRLHD-SOFGYWHQSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_1287
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: UZI/7123604; UBI_ID: UBI-001288
Synonyms	4-[3-(1,3-benzodioxol-5-yl)-2-propenoyl]-1-methyl-5,6,7,8-tetrahydro-3(2H)-isoquinolinone
Temperature	308 °C