| SpectraBase Spectrum ID |
KgepNEYdVDo |
| Name |
3-(S)-Methoxy-16-chloro-3,4-secocyanamide |
| Alternate Name(s) |
3-(S)-Methoxy-16-chloro-3,4-secocyanamide isomer |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28ClN3O3 |
| InChI |
InChI=1S/C22H28ClN3O3/c1-4-14-12-26(13-24)10-9-16-15-7-5-6-8-18(15)25-21(16)19(28-2)11-17(14)20(23)22(27)29-3/h5-8,14,17,19-20,25H,4,9-12H2,1-3H3/t14-,17-,19-,20?/m0/s1 |
| InChIKey |
WQGBMJJZIQJZCY-NIRXGJKVSA-N |
| Molecular Weight |
417.937 g/mol |
| SMILES |
[nH]1c2ccccc2c2c1[C@](C[C@@]([C@](CN(CC2)C#N)(CC)[H])(C(C(=O)OC)Cl)[H])(OC)[H] |
| SPLASH |
splash10-0uxr-0500900000-31c87480d35bea66fa17 |
| Source of Spectrum |
E1-39-1680-13 |
| Wiley ID |
1518948 |
