| SpectraBase Spectrum ID |
GnkVLNu8A7z |
| Name |
alanine, N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)-3,3,3-trifluoro-2-[(1-oxopropyl)amino]-, ethyl ester |
| 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/C18H22F3N3O3S/c1-3-14(25)23-17(18(19,20)21,16(26)27-4-2)24-15-12(10-22)11-8-6-5-7-9-13(11)28-15/h24H,3-9H2,1-2H3,(H,23,25) |
| InChIKey |
ZGAOCDGBNVPUBL-UHFFFAOYSA-N |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_CB_8313_2560 |
| 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/9321640; Labnumber: AU-t000754 |
| Temperature |
303 °C |
![alanine, N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)-3,3,3-trifluoro-2-[(1-oxopropyl)amino]-, ethyl ester](/api/spectrum/GnkVLNu8A7z/structure.png?h=300&w=458 "alanine, N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)-3,3,3-trifluoro-2-[(1-oxopropyl)amino]-, ethyl ester")
