| SpectraBase Spectrum ID |
5OESIEM9pls |
| Name |
(E)-3,12-diaza-1,2-dicyano-[3-(9-anthrylmethyl)]-[12-(2-pyridylmethyl)]-6,9-dioxacyclododecene |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H29N5O2 |
| InChI |
InChI=1S/C31H29N5O2/c32-20-30-31(21-33)36(14-16-38-18-17-37-15-13-35(30)22-26-9-5-6-12-34-26)23-29-27-10-3-1-7-24(27)19-25-8-2-4-11-28(25)29/h1-12,19H,13-18,22-23H2/b31-30+ |
| InChIKey |
QRHHTOHPYRJHQF-NVQSTNCTSA-N |
| Instrument Name |
Thermo Quest SSQ 711 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/hlca.202100028 |
| Molecular Weight |
503.606 g/mol |
| SMILES |
c1ccc2c(c1)c(CN1\C(=C/(C#N)N(CCOCCOCC1)Cc1ncccc1)C#N)c1c(c2)cccc1 |
| SPLASH |
splash10-0006-0901000000-d637072b704ecb469734 |
| Source of Spectrum |
H-104-SM9-8 |
| Thin-Layer Chromatography |
Rf = 0.51 (EE/MeOH, 9:1) |
| Wiley ID |
1867481 |
![(E)-3,12-diaza-1,2-dicyano-[3-(9-anthrylmethyl)]-[12-(2-pyridylmethyl)]-6,9-dioxacyclododecene](/api/spectrum/5OESIEM9pls/structure.png?h=300&w=458 "(E)-3,12-diaza-1,2-dicyano-[3-(9-anthrylmethyl)]-[12-(2-pyridylmethyl)]-6,9-dioxacyclododecene")
