N-{4-[(2E)-3-(1,3-benzodioxol-5-yl)-2-propenoyl]phenyl}-4-tert-butylbenzamide

SpectraBase Compound ID	CgDz4nWreYs
InChI	InChI=1S/C27H25NO4/c1-27(2,3)21-10-6-20(7-11-21)26(30)28-22-12-8-19(9-13-22)23(29)14-4-18-5-15-24-25(16-18)32-17-31-24/h4-16H,17H2,1-3H3,(H,28,30)/b14-4+
InChIKey	PTJPHWXNWPBHDJ-LNKIKWGQSA-N Google Search
Mol Weight	427.5 g/mol
Molecular Formula	C27H25NO4
Exact Mass	427.178358 g/mol

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SpectraBase Spectrum ID	3sOIVbgsDwq
Name	N-{4-[(2E)-3-(1,3-benzodioxol-5-yl)-2-propenoyl]phenyl}-4-tert-butylbenzamide
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/C27H25NO4/c1-27(2,3)21-10-6-20(7-11-21)26(30)28-22-12-8-19(9-13-22)23(29)14-4-18-5-15-24-25(16-18)32-17-31-24/h4-16H,17H2,1-3H3,(H,28,30)/b14-4+
InChIKey	PTJPHWXNWPBHDJ-LNKIKWGQSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_13520
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: 102288; Labnumber: RRHO-030; VK_ID: VK-013525
Synonyms	N-{4-[3-(1,3-benzodioxol-5-yl)-2-propenoyl]phenyl}-4-tert-butylbenzamide
Temperature	308 °C