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isopropyl 2-(benzoylamino)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
SpectraBase Compound ID 4TVyQriP9w5
InChI InChI=1S/C25H33NO3S/c1-18(2)29-25(28)22-20-16-12-7-5-3-4-6-8-13-17-21(20)30-24(22)26-23(27)19-14-10-9-11-15-19/h9-11,14-15,18H,3-8,12-13,16-17H2,1-2H3,(H,26,27)
InChIKey NIVNQCMCOLDZAL-UHFFFAOYSA-N
Mol Weight 427.6 g/mol
Molecular Formula C25H33NO3S
Exact Mass 427.218115 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4l3L1hzZerx
Name isopropyl 2-(benzoylamino)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[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/C25H33NO3S/c1-18(2)29-25(28)22-20-16-12-7-5-3-4-6-8-13-17-21(20)30-24(22)26-23(27)19-14-10-9-11-15-19/h9-11,14-15,18H,3-8,12-13,16-17H2,1-2H3,(H,26,27)
InChIKey NIVNQCMCOLDZAL-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_20622
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/9126675; Labnumber: U_AM_ACK/055287; UZI_ID: UZI-020630
Temperature 318 °C