| SpectraBase Spectrum ID |
H4ZYzkV6hjD |
| Name |
(R,R)-5,5-Diethoxypent-3yn-2-yl N-1-(phenylethyl)carbamate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
319.178358285 u |
| Formula |
C18H25NO4 |
| InChI |
InChI=1S/C18H25NO4/c1-5-21-17(22-6-2)13-12-14(3)23-18(20)19-15(4)16-10-8-7-9-11-16/h7-11,14-15,17H,5-6H2,1-4H3,(H,19,20)/t14-,15-/m1/s1 |
| InChIKey |
XMQMCXRZFKDORH-HUUCEWRRSA-N |
| Molecular Weight |
319.401 g/mol |
| SMILES |
C(N[C@@](C1=CC=CC=C1)(C)[H])(O[C@@](C#CC(OCC)OCC)(C)[H])=O |
