2-tert-butyl 4-ethyl 3-methyl-5-[(9H-xanthen-9-ylcarbonyl)amino]-2,4-thiophenedicarboxylate

SpectraBase Compound ID	2ENvSrOuOAq
InChI	InChI=1S/C27H27NO6S/c1-6-32-25(30)20-15(2)22(26(31)34-27(3,4)5)35-24(20)28-23(29)21-16-11-7-9-13-18(16)33-19-14-10-8-12-17(19)21/h7-14,21H,6H2,1-5H3,(H,28,29)
InChIKey	NHMDVBLSGKUVNC-UHFFFAOYSA-N Google Search
Mol Weight	493.57 g/mol
Molecular Formula	C27H27NO6S
Exact Mass	493.155909 g/mol

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SpectraBase Spectrum ID	J6jH3fp8b4X
Name	2-tert-butyl 4-ethyl 3-methyl-5-[(9H-xanthen-9-ylcarbonyl)amino]-2,4-thiophenedicarboxylate
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/C27H27NO6S/c1-6-32-25(30)20-15(2)22(26(31)34-27(3,4)5)35-24(20)28-23(29)21-16-11-7-9-13-18(16)33-19-14-10-8-12-17(19)21/h7-14,21H,6H2,1-5H3,(H,28,29)
InChIKey	NHMDVBLSGKUVNC-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_6507
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/8186016; UBI_ID: UBI-006509
Temperature	313 °C