| SpectraBase Spectrum ID |
19d8wvYv5c |
| Name |
12-[(3-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/c1-2-19-6-3-7-20(29(19)37)16-34-14-12-32-25(35)17-40-23-10-4-8-21-27(23)31(39)28-22(30(21)38)9-5-11-24(28)41-18-26(36)33-13-15-34/h3-11,37H,2,12-18H2,1H3,(H,32,35)(H,33,36) |
| InChIKey |
ZFMRWUMOENDQRW-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(c(ccc2)CC)O)CC1)C3=O)=O)=O |
| SPLASH |
splash10-0uxr-8192000000-612d8f0b69528cc185c1 |
| Source of Spectrum |
Y-53-172-172-8 |
| Thin-Layer Chromatography |
Rf = 0.40 (EtOH/EtOAc, 1:10) |
| Wiley ID |
1877530 |
![12-[(3-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/19d8wvYv5c/structure.png?h=300&w=458 "12-[(3-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")
