| SpectraBase Spectrum ID |
D1ofRn1358V |
| Name |
1-Propanone, 1-[5-[(dimethylamino)methylene]-1,3-cyclopentadien-1-yl]-2-methyl-, (E)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
191.131014170 u |
| Formula |
C12H17NO |
| InChI |
InChI=1S/C12H17NO/c1-9(2)12(14)11-6-5-10(7-11)8-13(3)4/h5-9H,1-4H3/b10-8+ |
| InChIKey |
QVZQWZBMBMYRGY-CSKARUKUSA-N |
| Molecular Weight |
191.274 g/mol |
| SMILES |
C1(=C\C(=C\N(C)C)C=C1)C(=O)C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.902523 |
![1-Propanone, 1-[5-[(dimethylamino)methylene]-1,3-cyclopentadien-1-yl]-2-methyl-, (E)-](/api/spectrum/D1ofRn1358V/structure.png?h=300&w=458 "1-Propanone, 1-[5-[(dimethylamino)methylene]-1,3-cyclopentadien-1-yl]-2-methyl-, (E)-")
