| SpectraBase Spectrum ID |
9RDMH77lXca |
| Name |
2-Azabutane, 1-[1-methylazacyclohex-2-yl]-2-methyl-4-[3,4-dichlorophenyl]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
314.131654181 u |
| Formula |
C16H24Cl2N2 |
| InChI |
InChI=1S/C16H24Cl2N2/c1-19(12-14-5-3-4-9-20(14)2)10-8-13-6-7-15(17)16(18)11-13/h6-7,11,14H,3-5,8-10,12H2,1-2H3 |
| InChIKey |
BBURUCNUCKNLNA-UHFFFAOYSA-N |
| Molecular Weight |
315.288 g/mol |
| SMILES |
C1CCCC(N1C)CN(C)CCC1=CC=C(C(=C1)Cl)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.815013 |
![2-Azabutane, 1-[1-methylazacyclohex-2-yl]-2-methyl-4-[3,4-dichlorophenyl]-](/api/spectrum/9RDMH77lXca/structure.png?h=300&w=458 "2-Azabutane, 1-[1-methylazacyclohex-2-yl]-2-methyl-4-[3,4-dichlorophenyl]-")
