| SpectraBase Spectrum ID |
3UpekKgPiHy |
| Name |
Benzenamine, 4-(2-butenyl)-2,6-dimethyl-, (E)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
175.136099551 u |
| Formula |
C12H17N |
| InChI |
InChI=1S/C12H17N/c1-4-5-6-11-7-9(2)12(13)10(3)8-11/h4-5,7-8H,6,13H2,1-3H3/b5-4+ |
| InChIKey |
ZRSFHBYIFWMYQG-SNAWJCMRSA-N |
| Molecular Weight |
175.275 g/mol |
| SMILES |
C=1(C(=CC(=CC1C)C\C=C\C)C)N |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.973294 |