(2E)-4-{[1-(1-adamantyl)ethyl]amino}-4-oxo-2-butenoic acid

SpectraBase Compound ID	KSDC41BCnpO
InChI	InChI=1S/C16H23NO3/c1-10(17-14(18)2-3-15(19)20)16-7-11-4-12(8-16)6-13(5-11)9-16/h2-3,10-13H,4-9H2,1H3,(H,17,18)(H,19,20)/b3-2+/t10?,11-,12+,13-,16-
InChIKey	QKFUEKJCUKCAMS-URPPILPRSA-N Google Search
Mol Weight	277.36 g/mol
Molecular Formula	C16H23NO3
Exact Mass	277.167794 g/mol

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SpectraBase Spectrum ID	HTyEdHjDk0A
Name	(2E)-4-{[1-(1-adamantyl)ethyl]amino}-4-oxo-2-butenoic acid
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/C16H23NO3/c1-10(17-14(18)2-3-15(19)20)16-7-11-4-12(8-16)6-13(5-11)9-16/h2-3,10-13H,4-9H2,1H3,(H,17,18)(H,19,20)/b3-2+/t10?,11-,12+,13-,16-
InChIKey	QKFUEKJCUKCAMS-URPPILPRSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_1856
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/8030928; UBI_ID: UBI-001857
Synonyms	4-{[1-(1-adamantyl)ethyl]amino}-4-oxo-2-butenoic acid
Temperature	318 °C