| SpectraBase Spectrum ID |
HpeKzzk2s9e |
| Name |
4,4'-Methylene-bis(2'-chloro-6'-methylaniline) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
294.069053923 u |
| Formula |
C15H16Cl2N2 |
| InChI |
InChI=1S/C15H16Cl2N2/c1-8-3-10(6-12(16)14(8)18)5-11-4-9(2)15(19)13(17)7-11/h3-4,6-7H,5,18-19H2,1-2H3 |
| InChIKey |
QZEOOWZAYKIUPR-UHFFFAOYSA-N |
| SMILES |
C=1(C(=CC(CC2=CC(Cl)=C(C(=C2)C)N)=CC1C)Cl)N |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.840263 |
