| SpectraBase Spectrum ID |
68vPigQ8W9M |
| Name |
Azacyclotridecan-2-one, 3-[(dimethylamino)methyl]-1-(2-propenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
294.267113722 u |
| Formula |
C18H34N2O |
| InChI |
InChI=1S/C18H34N2O/c1-4-14-20-15-12-10-8-6-5-7-9-11-13-17(18(20)21)16-19(2)3/h4,17H,1,5-16H2,2-3H3 |
| InChIKey |
PHNGJDZBWNVQJP-UHFFFAOYSA-N |
| SMILES |
C1(C(CN(C)C)CCCCCCCCCCN1CC=C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.844757 |
![Azacyclotridecan-2-one, 3-[(dimethylamino)methyl]-1-(2-propenyl)-](/api/spectrum/68vPigQ8W9M/structure.png?h=300&w=458 "Azacyclotridecan-2-one, 3-[(dimethylamino)methyl]-1-(2-propenyl)-")
