| SpectraBase Spectrum ID |
5W4TLJB9YMd |
| Name |
3-[3-(dimethylamino)propyl]-4-[(E)-1-methoxy-3-methyl-6-phenyl-hex-5-enyl]-1,2,3-oxadiazol-3-ium-5-olate |
| Alternate Name(s) |
3-[3-(dimethylamino)propyl]-4-[(E)-1-methoxy-3-methyl-6-phenyl-hex-5-enyl]oxadiazol-3-ium-5-olate
3-[3-(dimethylamino)propyl]-4-[(E)-1-methoxy-3-methyl-6-phenylhex-5-enyl]-5-oxadiazol-3-iumolate |
| Comments |
Removed - expert review: contamination (acetone)) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H31N3O3 |
| InChI |
InChI=1S/C21H31N3O3/c1-17(10-8-13-18-11-6-5-7-12-18)16-19(26-4)20-21(25)27-22-24(20)15-9-14-23(2)3/h5-8,11-13,17,19H,9-10,14-16H2,1-4H3/b13-8+ |
| InChIKey |
AFJRLMJSKZNPEX-MDWZMJQESA-N |
| Molecular Weight |
373.497 g/mol |
| SMILES |
c1([n+](noc1[O-])CCCN(C)C)C(CC(C\C=C\c1ccccc1)C)OC |
| SPLASH |
splash10-0a4i-9000000000-f916b6bdab336fec3ec3 |
| Source of Spectrum |
SO-0-1776-6 |
| Wiley ID |
878742 |
![3-[3-(dimethylamino)propyl]-4-[(E)-1-methoxy-3-methyl-6-phenyl-hex-5-enyl]-1,2,3-oxadiazol-3-ium-5-olate](/api/spectrum/5W4TLJB9YMd/structure.png?h=300&w=458 "3-[3-(dimethylamino)propyl]-4-[(E)-1-methoxy-3-methyl-6-phenyl-hex-5-enyl]-1,2,3-oxadiazol-3-ium-5-olate")
