| SpectraBase Spectrum ID |
4Zp2DXiiUv3 |
| Name |
(S)-(+)-2-sec-butyl-3-(dimethylamino)propenal |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
155.131014170 u |
| Formula |
C9H17NO |
| InChI |
InChI=1S/C9H17NO/c1-5-8(2)9(7-11)6-10(3)4/h6-8H,5H2,1-4H3/b9-6-/t8-/m0/s1 |
| InChIKey |
PBMQBOQMDZYCCY-HWPCKVLBSA-N |
| Molecular Weight |
155.241 g/mol |
| SMILES |
CN(\C=C\(C=O)[C@](CC)(C)[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.947064 |
