| SpectraBase Spectrum ID |
KXySo249m8J |
| Name |
methyl 2-({1-(ethoxycarbonyl)-1-[(ethoxycarbonyl)amino]-2,2,2-trifluoroethyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-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/C18H23F3N2O6S/c1-4-28-15(25)17(18(19,20)21,23-16(26)29-5-2)22-13-12(14(24)27-3)10-8-6-7-9-11(10)30-13/h22H,4-9H2,1-3H3,(H,23,26) |
| InChIKey |
VPVVNMFEISWAQF-UHFFFAOYSA-N |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_ASIOH_7000_4636 |
| 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: NMR/9233257; Labnumber: AU-EC00822; IOH_ID: IOH-004637 |
| Temperature |
303 °C |
![methyl 2-({1-(ethoxycarbonyl)-1-[(ethoxycarbonyl)amino]-2,2,2-trifluoroethyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate](/api/spectrum/KXySo249m8J/structure.png?h=300&w=458 "methyl 2-({1-(ethoxycarbonyl)-1-[(ethoxycarbonyl)amino]-2,2,2-trifluoroethyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate")
