| SpectraBase Spectrum ID |
Bmm9U3kLaip |
| Name |
2-[3',5'-di(t-Butyl)-4'-hydroxyphenyl)-3-(N-methylpiperazin-1"-yl)-1,4-naphthoquinone |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H36N2O3 |
| InChI |
InChI=1S/C29H36N2O3/c1-28(2,3)21-16-18(17-22(27(21)34)29(4,5)6)23-24(31-14-12-30(7)13-15-31)26(33)20-11-9-8-10-19(20)25(23)32/h8-11,16-17,34H,12-15H2,1-7H3 |
| InChIKey |
DJDQSSSVDBCOCD-UHFFFAOYSA-N |
| Molecular Weight |
460.618 g/mol |
| SMILES |
Oc1c(cc(C2=C(C(=O)c3c(C2=O)cccc3)N2CCN(CC2)C)cc1C(C)(C)C)C(C)(C)C |
| SPLASH |
splash10-03r0-9000900000-f2420541ae9580e6ee37 |
| Source of Spectrum |
D8-324-495-13 |
| Wiley ID |
1514163 |
