| SpectraBase Spectrum ID |
5ylhGIlv7NX |
| Name |
12-[(4-ethyl-2-hydroxyphenyl)methyl]-6,18-dioxa-9,12,15-triazatetracyclo[21.3.1.0(5,26).0(19,24)]heptacosa-1(26),2,4,19,21,23-hexaene-8,16,25,27-tetrone |
| Appearance |
Yellow crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H31N3O7 |
| InChI |
InChI=1S/C31H31N3O7/c1-2-19-9-10-20(23(35)15-19)16-34-13-11-32-26(36)17-40-24-7-3-5-21-28(24)31(39)29-22(30(21)38)6-4-8-25(29)41-18-27(37)33-12-14-34/h3-10,15,35H,2,11-14,16-18H2,1H3,(H,32,36)(H,33,37) |
| InChIKey |
DIXSRVZRLOWRHE-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS-QP 1000 EX |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.1811 |
| Molecular Weight |
557.603 g/mol |
| SMILES |
N1C(COc2cccc3c2C(c2c(cccc2OCC(=O)NCCN(Cc2c(cc(cc2)CC)O)CC1)C3=O)=O)=O |
| SPLASH |
splash10-0uxr-8193100000-1641c743e3137ea25cb0 |
| Source of Spectrum |
Y-53-172-172-7 |
| Thin-Layer Chromatography |
Rf = 0.53 (EtOH/EtOAc, 1:10) |
| Wiley ID |
1877529 |
![12-[(4-ethyl-2-hydroxyphenyl)methyl]-6,18-dioxa-9,12,15-triazatetracyclo[21.3.1.0(5,26).0(19,24)]heptacosa-1(26),2,4,19,21,23-hexaene-8,16,25,27-tetrone](/api/spectrum/5ylhGIlv7NX/structure.png?h=300&w=458 "12-[(4-ethyl-2-hydroxyphenyl)methyl]-6,18-dioxa-9,12,15-triazatetracyclo[21.3.1.0(5,26).0(19,24)]heptacosa-1(26),2,4,19,21,23-hexaene-8,16,25,27-tetrone")
