SpectraBase Spectrum ID |
2vvxVAqbqpH |
Name |
rac-3-[(Hexadecylamino)(3,5-dibromo-2-hydroxyphenyl)methyl]-2-hydroxy-1,4-naphthoquinone |
Appearance |
Orange solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C33H43Br2NO4 |
InChI |
InChI=1S/C33H43Br2NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20-36-29(26-21-23(34)22-27(35)30(26)37)28-31(38)24-18-15-16-19-25(24)32(39)33(28)40/h15-16,18-19,21-22,29,36-37,40H,2-14,17,20H2,1H3 |
InChIKey |
RBVMXYIQTGYZTB-UHFFFAOYSA-N |
Instrument Name |
Varian MAT 311 A |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/ardp.201900128 |
Molecular Weight |
677.518 g/mol |
SMILES |
N(C(c1cc(cc(c1O)Br)Br)C=1C(c2c(C(=O)C1O)cccc2)=O)CCCCCCCCCCCCCCCC |
SPLASH |
splash10-0a4r-8703921000-9ded65abb170f19426d2 |
Source of Spectrum |
APC-352-6-3c |
Wiley ID |
1838352 |