phenylmethanaminium 5-[(1Z)-3-hydroxy-2-methyl-1-propenyl]-2-methyl-3-furoate

SpectraBase Compound ID	EMGQZslA4RF
InChI	InChI=1S/C10H12O4.C7H9N/c1-6(5-11)3-8-4-9(10(12)13)7(2)14-8;8-6-7-4-2-1-3-5-7/h3-4,11H,5H2,1-2H3,(H,12,13);1-5H,6,8H2/b6-3-;
InChIKey	KDOIZKWVELGQJZ-AQPBACSKSA-N Google Search
Mol Weight	303.36 g/mol
Molecular Formula	C17H21NO4
Exact Mass	303.147058 g/mol

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SpectraBase Spectrum ID	6RG2DPKPIqV
Name	phenylmethanaminium 5-[(1Z)-3-hydroxy-2-methyl-1-propenyl]-2-methyl-3-furoate
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/C10H12O4.C7H9N/c1-6(5-11)3-8-4-9(10(12)13)7(2)14-8;8-6-7-4-2-1-3-5-7/h3-4,11H,5H2,1-2H3,(H,12,13);1-5H,6,8H2/b6-3-;
InChIKey	KDOIZKWVELGQJZ-AQPBACSKSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_12543
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: 100376; Labnumber: KRAS-174; VK_ID: VK-012548
Synonyms	phenylmethanaminium 5-[3-hydroxy-2-methyl-1-propenyl]-2-methyl-3-furoate
Temperature	308 °C