| SpectraBase Spectrum ID |
4qFUgyzORKP |
| Name |
(Z)-2-(Tert-butoxycarbonylamino)-5-phenyl-pent-2-en-4-ynoic acid ethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
315.147058156 u |
| Formula |
C18H21NO4 |
| InChI |
InChI=1S/C18H21NO4/c1-5-22-16(20)15(19-17(21)23-18(2,3)4)13-9-12-14-10-7-6-8-11-14/h6-8,10-11,13H,5H2,1-4H3,(H,19,21)/b15-13- |
| InChIKey |
FMZAHPPMECCCEU-SQFISAMPSA-N |
| SMILES |
C(N\C(C(=O)OCC)=C\C#CC1=CC=CC=C1)(OC(C)(C)C)=O |
