SpectraBase Spectrum ID |
1iWCdZTwiNn |
Name |
1,3-benzodioxole-5-methanaminium, N-[(4-carboxyphenyl)methyl]-, chloride |
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/C16H15NO4.ClH/c18-16(19)13-4-1-11(2-5-13)8-17-9-12-3-6-14-15(7-12)21-10-20-14;/h1-7,17H,8-10H2,(H,18,19);1H |
InChIKey |
HENYCMCTTLZXLR-UHFFFAOYSA-N |
NMR Offset |
15.5012 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_SBI_11628_3513 |
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: F17822; Labnumber: SPHRAM1-29137 |