6-[(4-bromoanilino)carbonyl]-3,4-dimethyl-3-cyclohexene-1-carboxylic acid

SpectraBase Compound ID	5LCtRs7ISZL
InChI	InChI=1S/C16H18BrNO3/c1-9-7-13(14(16(20)21)8-10(9)2)15(19)18-12-5-3-11(17)4-6-12/h3-6,13-14H,7-8H2,1-2H3,(H,18,19)(H,20,21)
InChIKey	XAZMYHWJZOAHHV-UHFFFAOYSA-N Google Search
Mol Weight	352.23 g/mol
Molecular Formula	C16H18BrNO3
Exact Mass	351.047006 g/mol

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SpectraBase Spectrum ID	g79JmIoXzi
Name	6-[(4-bromoanilino)carbonyl]-3,4-dimethyl-3-cyclohexene-1-carboxylic 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/C16H18BrNO3/c1-9-7-13(14(16(20)21)8-10(9)2)15(19)18-12-5-3-11(17)4-6-12/h3-6,13-14H,7-8H2,1-2H3,(H,18,19)(H,20,21)
InChIKey	XAZMYHWJZOAHHV-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_15528
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/9686935; Labnumber: NSB-0098863; UZI_ID: UZI-015532
Temperature	308 °C