| SpectraBase Spectrum ID |
7oBSSp4plQ1 |
| Name |
3-(2-((butylamino)methyl)-1H-pyrrol-1-yl)-4,5,6,7-tetrahydrobenzo[b]thiophene-2-carbonitrile oxalate |
| 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/C18H23N3S.C2H2O4/c1-2-3-10-20-13-14-7-6-11-21(14)18-15-8-4-5-9-16(15)22-17(18)12-19;3-1(4)2(5)6/h6-7,11,20H,2-5,8-10,13H2,1H3;(H,3,4)(H,5,6) |
| InChIKey |
QWZCRXZEVQMJCQ-UHFFFAOYSA-N |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Origin |
1H_ASIOH_8516_2376 |
| 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: ZI/6012774; Labnumber: SMM-645; IOH_ID: IOH-009379 |
![3-(2-((butylamino)methyl)-1H-pyrrol-1-yl)-4,5,6,7-tetrahydrobenzo[b]thiophene-2-carbonitrile oxalate](/api/spectrum/7oBSSp4plQ1/structure.png?h=300&w=458 "3-(2-((butylamino)methyl)-1H-pyrrol-1-yl)-4,5,6,7-tetrahydrobenzo[b]thiophene-2-carbonitrile oxalate")
