| SpectraBase Spectrum ID |
JlhBl7YUGjt |
| Name |
4-[(3-cyano-6-tert-pentyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)amino]-4-oxobutanoic acid |
| 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/C18H24N2O3S/c1-4-18(2,3)11-5-6-12-13(10-19)17(24-14(12)9-11)20-15(21)7-8-16(22)23/h11H,4-9H2,1-3H3,(H,20,21)(H,22,23) |
| InChIKey |
FGHXNFBPYOOMGF-UHFFFAOYSA-N |
| NMR Offset |
15.449 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_UBI_21270_2848 |
| 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/8066428; UBI_ID: UBI-002849 |
| Temperature |
308 °C |
![4-[(3-cyano-6-tert-pentyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)amino]-4-oxobutanoic acid](/api/spectrum/JlhBl7YUGjt/structure.png?h=300&w=458 "4-[(3-cyano-6-tert-pentyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)amino]-4-oxobutanoic acid")
