(5E)-5-[(1-benzyl-1H-indol-3-yl)methylene]-1-heptyl-2,4,6(1H,3H,5H)-pyrimidinetrione

SpectraBase Compound ID	AcBzmMLfdU
InChI	InChI=1S/C27H29N3O3/c1-2-3-4-5-11-16-30-26(32)23(25(31)28-27(30)33)17-21-19-29(18-20-12-7-6-8-13-20)24-15-10-9-14-22(21)24/h6-10,12-15,17,19H,2-5,11,16,18H2,1H3,(H,28,31,33)/b23-17+
InChIKey	MGOYZVKDBVPYIH-HAVVHWLPSA-N Google Search
Mol Weight	443.55 g/mol
Molecular Formula	C27H29N3O3
Exact Mass	443.220892 g/mol

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SpectraBase Spectrum ID	AVTcbYCaFTd
Name	(5E)-5-[(1-benzyl-1H-indol-3-yl)methylene]-1-heptyl-2,4,6(1H,3H,5H)-pyrimidinetrione
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/C27H29N3O3/c1-2-3-4-5-11-16-30-26(32)23(25(31)28-27(30)33)17-21-19-29(18-20-12-7-6-8-13-20)24-15-10-9-14-22(21)24/h6-10,12-15,17,19H,2-5,11,16,18H2,1H3,(H,28,31,33)/b23-17+
InChIKey	MGOYZVKDBVPYIH-HAVVHWLPSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_10782
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: E03114; Labnumber: KV-2607; SBI_ID: SBI-010785
Synonyms	5-[(1-benzyl-1H-indol-3-yl)methylene]-1-heptyl-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature	308 °C