CID 11819394

4-methoxy-n1,n1-dimethylbenzene-1,2-diamine dihydrochloride

Structural Information

Molecular Formula
C9H14N2O
SMILES
CN(C)C1=C(C=C(C=C1)OC)N
InChI
InChI=1S/C9H14N2O/c1-11(2)9-5-4-7(12-3)6-8(9)10/h4-6H,10H2,1-3H3
InChIKey
YEGNBGWUKGEOAJ-UHFFFAOYSA-N
Compound name
4-methoxy-1-N,1-N-dimethylbenzene-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

166.11061 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.117886 135.2
[M+Na]+ 189.099828 142.9
[M-H]- 165.103334 140.4
[M+NH4]+ 184.144433 156.2
[M+K]+ 205.073768 142.6
[M+H-H2O]+ 149.107870 129.0
[M+HCOO]- 211.108811 162.0
[M+CH3COO]- 225.124461 188.2
[M+Na-2H]- 187.085276 140.7
[M]+ 166.11006142 136.1
[M]- 166.11115858 136.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe