N-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]aspartic acid

SpectraBase Compound ID	1V2l9KJzrlt
InChI	InChI=1S/C13H17NO6/c1-13(2)4-9(15)7(10(16)5-13)6-14-8(12(19)20)3-11(17)18/h6,8,14H,3-5H2,1-2H3,(H,17,18)(H,19,20)
InChIKey	VSKAAGHROGMFPF-UHFFFAOYSA-N Google Search
Mol Weight	283.28 g/mol
Molecular Formula	C13H17NO6
Exact Mass	283.105587 g/mol

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SpectraBase Spectrum ID	3kRvQUJxaul
Name	N-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]aspartic 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/C13H17NO6/c1-13(2)4-9(15)7(10(16)5-13)6-14-8(12(19)20)3-11(17)18/h6,8,14H,3-5H2,1-2H3,(H,17,18)(H,19,20)
InChIKey	VSKAAGHROGMFPF-UHFFFAOYSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_24034
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: D44192; Labnumber: GRAN211-031; SBI_ID: SBI-024038
Temperature	308 °C