| SpectraBase Spectrum ID |
B4WoBTuWJ8a |
| Name |
3-N-(2-fluoropropyl)spiperone |
| Alternate Name(s) |
8-[4-(4-fluorophenyl)-4-oxobutyl]-3-(2-fluoropropyl)-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one |
| CAS Registry Number |
106114-46-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H31F2N3O2 |
| InChI |
InChI=1S/C26H31F2N3O2/c1-20(27)18-30-19-31(23-6-3-2-4-7-23)26(25(30)33)13-16-29(17-14-26)15-5-8-24(32)21-9-11-22(28)12-10-21/h2-4,6-7,9-12,20H,5,8,13-19H2,1H3 |
| InChIKey |
HPARITCICJRQAT-UHFFFAOYSA-N |
| Molecular Weight |
455.550 g/mol |
| SMILES |
C1(N(CN(C11CCN(CC1)CCCC(c1ccc(cc1)F)=O)c1ccccc1)CC(F)C)=O |
| SPLASH |
splash10-0v4l-6928200000-99e593ff8a1f02fb1cd9 |
| Source of Spectrum |
J-52-663-8 |
| Wiley ID |
1389060 |
