| SpectraBase Spectrum ID |
AS18mMXCWT |
| Name |
1-(2'-Benzothiazolyl)ethenyl-5-methoxy-1,4,7,10,13-pentaoxabenzo[3,4-B][15-crown-5] |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
457.155908761 u |
| Formula |
C24H27NO6S |
| InChI |
InChI=1S/C24H27NO6S/c1-26-19-4-6-23-20(17-19)25-24(32-23)7-3-18-2-5-21-22(16-18)31-15-13-29-11-9-27-8-10-28-12-14-30-21/h2-7,16-17H,8-15H2,1H3/b7-3+ |
| InChIKey |
BXNJXWQTOLQUDM-XVNBXDOJSA-N |
| Molecular Weight |
457.541 g/mol |
| SMILES |
C1(=NC=2C(S1)=CC=C(C2)OC)\C=C\C=1C=C2OCCOCCOCCOCCOC2=CC1 |
![1-(2'-Benzothiazolyl)ethenyl-5-methoxy-1,4,7,10,13-pentaoxabenzo[3,4-b][15-crown-5]](/api/spectrum/AS18mMXCWT/structure.png?h=300&w=458 "1-(2'-Benzothiazolyl)ethenyl-5-methoxy-1,4,7,10,13-pentaoxabenzo[3,4-b][15-crown-5]")
