ethyl 2-[(4-methoxy-3-nitrobenzoyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate

SpectraBase Compound ID	GBJdMpDY8si
InChI	InChI=1S/C21H24N2O6S/c1-3-29-21(25)18-14-8-6-4-5-7-9-17(14)30-20(18)22-19(24)13-10-11-16(28-2)15(12-13)23(26)27/h10-12H,3-9H2,1-2H3,(H,22,24)
InChIKey	BAZUBIIDCCWACS-UHFFFAOYSA-N Google Search
Mol Weight	432.49 g/mol
Molecular Formula	C21H24N2O6S
Exact Mass	432.135508 g/mol

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SpectraBase Spectrum ID	BEfk7MvHl8O
Name	ethyl 2-[(4-methoxy-3-nitrobenzoyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
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/C21H24N2O6S/c1-3-29-21(25)18-14-8-6-4-5-7-9-17(14)30-20(18)22-19(24)13-10-11-16(28-2)15(12-13)23(26)27/h10-12H,3-9H2,1-2H3,(H,22,24)
InChIKey	BAZUBIIDCCWACS-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_19804
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/9157190; Labnumber: U_AM_ACK/016528; UZI_ID: UZI-019812
Temperature	318 °C