| SpectraBase Spectrum ID |
1d9LMKagsQy |
| Name |
4-{[3-(ethoxycarbonyl)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thien-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/C21H31NO5S/c1-2-27-21(26)19-15-11-9-7-5-3-4-6-8-10-12-16(15)28-20(19)22-17(23)13-14-18(24)25/h2-14H2,1H3,(H,22,23)(H,24,25) |
| InChIKey |
KDOMMGRSVFMUFT-UHFFFAOYSA-N |
| NMR Offset |
15.328 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_UBI_21270_17737 |
| 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/9067990; UBI_ID: UBI-017740 |
| Temperature |
318 °C |
![4-{[3-(ethoxycarbonyl)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thien-2-yl]amino}-4-oxobutanoic acid](/api/spectrum/1d9LMKagsQy/structure.png?h=300&w=458 "4-{[3-(ethoxycarbonyl)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thien-2-yl]amino}-4-oxobutanoic acid")
