SpectraBase Spectrum ID |
Dqza2400SYM |
Name |
rac-3-[(Hexadecylamino)(5-nitrofuran-2-yl)methyl]-2-hydroxy-1,4-naphthoquinone |
Appearance |
Orange-red solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C31H42N2O6 |
InChI |
InChI=1S/C31H42N2O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-22-32-28(25-20-21-26(39-25)33(37)38)27-29(34)23-18-15-16-19-24(23)30(35)31(27)36/h15-16,18-21,28,32,36H,2-14,17,22H2,1H3 |
InChIKey |
CAUOABCYSRYYOE-UHFFFAOYSA-N |
Instrument Name |
Varian MAT 311 A |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/ardp.201900128 |
Molecular Weight |
538.685 g/mol |
SMILES |
N(C(C1=C(C(c2c(C1=O)cccc2)=O)O)c1ccc([N+]([O-])=O)o1)CCCCCCCCCCCCCCCC |
SPLASH |
splash10-0002-0902000000-99911daf22d8eeb189ca |
Source of Spectrum |
APC-352-6-3d |
Wiley ID |
1838353 |