5-Hydroxy-1-(3-isopropoxy-propyl)-2-methyl-1H-benzo[g]indole-3-carboxylic acid methyl ester

SpectraBase Compound ID	2GTiLY8jk3o
InChI	InChI=1S/C21H25NO4/c1-13(2)26-11-7-10-22-14(3)19(21(24)25-4)17-12-18(23)15-8-5-6-9-16(15)20(17)22/h5-6,8-9,12-13,23H,7,10-11H2,1-4H3
InChIKey	JYKUAQIQTUVFGG-UHFFFAOYSA-N Google Search
Mol Weight	355.43 g/mol
Molecular Formula	C21H25NO4
Exact Mass	355.178358 g/mol

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SpectraBase Spectrum ID	Co9X9oS4V9j
Name	1H-benz[g]indole-3-carboxylic acid, 5-hydroxy-2-methyl-1-[3-(1-methylethoxy)propyl]-, methyl ester
Copyright	Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	355.178358285 u
Formula	C21H25NO4
InChI	InChI=1S/C21H25NO4/c1-13(2)26-11-7-10-22-14(3)19(21(24)25-4)17-12-18(23)15-8-5-6-9-16(15)20(17)22/h5-6,8-9,12-13,23H,7,10-11H2,1-4H3
InChIKey	JYKUAQIQTUVFGG-UHFFFAOYSA-N
Molecular Weight	355.434 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_12066
Solvent	DMSO-d6
Source	Vendor ID: NMR/10271858; Lab Info: LP; Lab Number: LP-0103171