4-methyl-4-[(5-nitro-1,3-benzoxazol-2-yl)amino]-2-pentanone

SpectraBase Compound ID	IJVR7Sr0GVw
InChI	InChI=1S/C13H15N3O4/c1-8(17)7-13(2,3)15-12-14-10-6-9(16(18)19)4-5-11(10)20-12/h4-6H,7H2,1-3H3,(H,14,15)
InChIKey	IRKCGOLTZZASTC-UHFFFAOYSA-N Google Search
Mol Weight	277.28 g/mol
Molecular Formula	C13H15N3O4
Exact Mass	277.106256 g/mol

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SpectraBase Spectrum ID	Eu7tqESIC41
Name	4-methyl-4-[(5-nitro-1,3-benzoxazol-2-yl)amino]-2-pentanone
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/C13H15N3O4/c1-8(17)7-13(2,3)15-12-14-10-6-9(16(18)19)4-5-11(10)20-12/h4-6H,7H2,1-3H3,(H,14,15)
InChIKey	IRKCGOLTZZASTC-UHFFFAOYSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_15130
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: C28976; Labnumber: BMG1-131; SBI_ID: SBI-015133
Temperature	308 °C