| SpectraBase Spectrum ID |
JexTS97MDdh |
| Name |
(Z)-(S)-Tert-butyl 5-morpholino-3-phenyl-6,6-dimethyl-4-heptenoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
373.261693988 u |
| Formula |
C23H35NO3 |
| InChI |
InChI=1S/C23H35NO3/c1-22(2,3)20(24-12-14-26-15-13-24)16-19(18-10-8-7-9-11-18)17-21(25)27-23(4,5)6/h7-11,16,19H,12-15,17H2,1-6H3/b20-16-/t19-/m1/s1 |
| InChIKey |
FKUCAUBMUKTJQW-WDULPBOOSA-N |
| Molecular Weight |
373.537 g/mol |
| SMILES |
[C@](\C=C\(N1CCOCC1)C(C)(C)C)(CC(OC(C)(C)C)=O)(C1=CC=CC=C1)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.957474 |
