N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-1,3-benzodioxole-5-carboxamide

SpectraBase Compound ID	3ayI257vIp0
InChI	InChI=1S/C21H22N2O3S/c24-19(15-1-2-16-17(6-15)26-11-25-16)23-20-22-18(10-27-20)21-7-12-3-13(8-21)5-14(4-12)9-21/h1-2,6,10,12-14H,3-5,7-9,11H2,(H,22,23,24)
InChIKey	XQMZAZDWRCUITK-UHFFFAOYSA-N Google Search
Mol Weight	382.48 g/mol
Molecular Formula	C21H22N2O3S
Exact Mass	382.135114 g/mol

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SpectraBase Spectrum ID	BClKzkJi9vZ
Name	N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-1,3-benzodioxole-5-carboxamide
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/C21H22N2O3S/c24-19(15-1-2-16-17(6-15)26-11-25-16)23-20-22-18(10-27-20)21-7-12-3-13(8-21)5-14(4-12)9-21/h1-2,6,10,12-14H,3-5,7-9,11H2,(H,22,23,24)
InChIKey	XQMZAZDWRCUITK-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_19466
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/9142980; UBI_ID: UBI-019470
Temperature	318 °C