| SpectraBase Spectrum ID |
JTGaK3g6Vs3 |
| Name |
12H-7,11-Nitrilo-6H-dibenzo[b,k][1,4,7,10,13]pentaoxacycloeicosin-8-c arboxylic acid, 19,20,22,23-tetrahydro-, ethyl ester |
| Alternate Name(s) |
Bis(benzo), 3-carboethoxy pyridine derivative of 18-crown-6
ethyl 3,10,13,16,23-pentaoxa-29-azatetracyclo[23.3.1.0(4,9).0(17,22)]nonacosa-1(29),4,6,8,17,19,21,25,27-nonaene-26-carboxylate |
| CAS Registry Number |
87390-13-4 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H27NO7 |
| InChI |
InChI=1S/C26H27NO7/c1-2-30-26(28)20-12-11-19-17-33-24-9-5-3-7-22(24)31-15-13-29-14-16-32-23-8-4-6-10-25(23)34-18-21(20)27-19/h3-12H,2,13-18H2,1H3 |
| InChIKey |
CSAQGCWTZPWKJW-UHFFFAOYSA-N |
| Molecular Weight |
465.502 g/mol |
| SMILES |
c1(c2nc(cc1)COc1c(OCCOCCOc3c(OC2)cccc3)cccc1)C(=O)OCC |
| SPLASH |
splash10-00xr-0900700000-de62e11c5e21fcb107a6 |
| Source of Spectrum |
F-39-2007-0 |
| Wiley ID |
1391729 |
![12H-7,11-Nitrilo-6H-dibenzo[b,k][1,4,7,10,13]pentaoxacycloeicosin-8-c arboxylic acid, 19,20,22,23-tetrahydro-, ethyl ester](/api/spectrum/JTGaK3g6Vs3/structure.png?h=300&w=458 "12H-7,11-Nitrilo-6H-dibenzo[b,k][1,4,7,10,13]pentaoxacycloeicosin-8-c arboxylic acid, 19,20,22,23-tetrahydro-, ethyl ester")
