| SpectraBase Spectrum ID |
BcRt0x6Fvrs |
| Name |
(S)-Tert-butyl N-(2,2-difluoro-1-(4-methoxyphenyl)-3-oxo-3-phenylpropyl)carbamate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
391.159514547 u |
| Formula |
C21H23F2NO4 |
| InChI |
InChI=1S/C21H23F2NO4/c1-20(2,3)28-19(26)24-17(14-10-12-16(27-4)13-11-14)21(22,23)18(25)15-8-6-5-7-9-15/h5-13,17H,1-4H3,(H,24,26)/t17-/m0/s1 |
| InChIKey |
YOLOZCDKTOPUTL-KRWDZBQOSA-N |
| Molecular Weight |
391.415 g/mol |
| SMILES |
C(F)([C@](C1=CC=C(C=C1)OC)(NC(=O)OC(C)(C)C)[H])(C(C=1C=CC=CC1)=O)F |
