SpectraBase Spectrum ID |
Ir3LGqaxJTo |
Name |
2,6-Bis[1-(carboxymethyl)-4,5,6,7-tetrahydrobenzopyrazol-3-yl]pyridine Bis(tertmethylammonium) Salt |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C31H47N7O4 |
InChI |
InChI=1S/C23H25N5O4.2C4H12N/c29-20(30)12-27-18-10-3-1-6-14(18)22(25-27)16-8-5-9-17(24-16)23-15-7-2-4-11-19(15)28(26-23)13-21(31)32;2*1-5(2,3)4/h5,8-9H,1-4,6-7,10-13H2,(H,29,30)(H,31,32);2*1-4H3/q;2*+1/p-2 |
InChIKey |
MSJNXBKRQKKHOU-UHFFFAOYSA-L |
Molecular Weight |
581.762 g/mol |
SMILES |
C[N+](C)(C)C.c1(n[n](c2c1CCCC2)CC([O-])=O)-c1nc(-c2n[n](CC([O-])=O)c3c2CCCC3)ccc1.C[N+](C)(C)C |
SPLASH |
splash10-01pc-7035900000-506c59707d58535f097b |
Source of Spectrum |
J-59-1770-13oo |
Wiley ID |
1408576 |