3-isoxazolecarboxylic acid, 4,5-dihydro-5-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-

SpectraBase Compound ID	K40I1O4m3Ai
InChI	InChI=1S/C13H13NO6/c1-17-10-3-7(4-11-12(10)19-6-18-11)2-8-5-9(13(15)16)14-20-8/h3-4,8H,2,5-6H2,1H3,(H,15,16)
InChIKey	GNGUVVPYFWBCQX-UHFFFAOYSA-N Google Search
Mol Weight	279.25 g/mol
Molecular Formula	C13H13NO6
Exact Mass	279.074287 g/mol

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SpectraBase Spectrum ID	A63t0XyokWJ
Name	3-isoxazolecarboxylic acid, 4,5-dihydro-5-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-
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/C13H13NO6/c1-17-10-3-7(4-11-12(10)19-6-18-11)2-8-5-9(13(15)16)14-20-8/h3-4,8H,2,5-6H2,1H3,(H,15,16)
InChIKey	GNGUVVPYFWBCQX-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7529_5120
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: NMR/17311301; Labnumber: 146