| SpectraBase Spectrum ID |
DbprQL3yfI0 |
| Name |
1-Piperidinepropanoic acid, .alpha.-[(4-chlorophenyl)sulfinyl]-2-methyl-.beta.-phenyl-, methyl ester |
| CAS Registry Number |
102714-51-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H26ClNO3S |
| InChI |
InChI=1S/C22H26ClNO3S/c1-16-8-6-7-15-24(16)20(17-9-4-3-5-10-17)21(22(25)27-2)28(26)19-13-11-18(23)12-14-19/h3-5,9-14,16,20-21H,6-8,15H2,1-2H3 |
| InChIKey |
OAHRGNXPTYDTTP-UHFFFAOYSA-N |
| Molecular Weight |
419.967 g/mol |
| SMILES |
C(C(N1C(C)CCCC1)c1ccccc1)(S(c1ccc(cc1)Cl)=O)C(=O)OC |
| SPLASH |
splash10-03di-0900000000-d5536780d88779b4e753 |
| Source of Spectrum |
KC-1987-829-8 |
| Synonyms |
Methyl 2-(p-chlorophenylsulphinyl)-3-(2-methylpiperidino)-3-phenylpropanoate
methyl 2-[(4-chlorophenyl)sulfinyl]-3-(2-methyl-1-piperidinyl)-3-phenylpropanoate |
| Wiley ID |
1377586 |
![1-Piperidinepropanoic acid, .alpha.-[(4-chlorophenyl)sulfinyl]-2-methyl-.beta.-phenyl-, methyl ester](/api/spectrum/DbprQL3yfI0/structure.png?h=300&w=458 "1-Piperidinepropanoic acid, .alpha.-[(4-chlorophenyl)sulfinyl]-2-methyl-.beta.-phenyl-, methyl ester")
