SpectraBase Spectrum ID |
56vh8QzAKUD |
Name |
methyl 3-{[(3-chloro-1-adamantyl)carbonyl]amino}-1H-indole-2-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/C21H23ClN2O3/c1-27-18(25)17-16(14-4-2-3-5-15(14)23-17)24-19(26)20-7-12-6-13(8-20)10-21(22,9-12)11-20/h2-5,12-13,23H,6-11H2,1H3,(H,24,26)/t12-,13+,20+,21- |
InChIKey |
FYOQZXZMHZKLLH-NOKWSWOQSA-N |
NMR Offset |
15.5012 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_UBI-VK_18310_8469 |
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: 127999; Labnumber: SIMAK-00068; VK_ID: VK-008473 |
Temperature |
315 °C |