2-(3,4-dimethoxyphenethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione

SpectraBase Compound ID	2Mtjrblaf2K
InChI	InChI=1S/C21H23NO4/c1-25-16-6-3-11(9-17(16)26-2)7-8-22-20(23)18-12-4-5-13(15-10-14(12)15)19(18)21(22)24/h3-6,9,12-15,18-19H,7-8,10H2,1-2H3/t12-,13+,14+,15-,18?,19?
InChIKey	YJWKFEOPTCAJCT-HDIBRJSYSA-N Google Search
Mol Weight	353.42 g/mol
Molecular Formula	C21H23NO4
Exact Mass	353.162708 g/mol

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SpectraBase Spectrum ID	I4WyL8afsm9
Name	2-(3,4-dimethoxyphenethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
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/C21H23NO4/c1-25-16-6-3-11(9-17(16)26-2)7-8-22-20(23)18-12-4-5-13(15-10-14(12)15)19(18)21(22)24/h3-6,9,12-15,18-19H,7-8,10H2,1-2H3/t12-,13+,14+,15-,18?,19?
InChIKey	YJWKFEOPTCAJCT-HDIBRJSYSA-N
NMR Offset	13.9821
NMR Spectrometer Frequency	250.134
Observed nucleus	1H
Origin	1H_ASIOH_8516_3495
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: AG-205/5117400; Labnumber: LD-690b; IOH_ID: IOH-010498
Temperature	297 °C