CID 28599443

4-[(dimethylamino)methyl]-2-methylaniline

Structural Information

Molecular Formula
C10H16N2
SMILES
CC1=C(C=CC(=C1)CN(C)C)N
InChI
InChI=1S/C10H16N2/c1-8-6-9(7-12(2)3)4-5-10(8)11/h4-6H,7,11H2,1-3H3
InChIKey
OQUKPEYUVQSUIM-UHFFFAOYSA-N
Compound name
4-[(dimethylamino)methyl]-2-methylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

164.13135 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.13863 136.7
[M+Na]+ 187.12057 144.0
[M-H]- 163.12407 141.7
[M+NH4]+ 182.16517 157.8
[M+K]+ 203.09451 142.9
[M+H-H2O]+ 147.12861 130.5
[M+HCOO]- 209.12955 162.8
[M+CH3COO]- 223.14520 189.2
[M+Na-2H]- 185.10602 141.7
[M]+ 164.13080 136.5
[M]- 164.13190 136.5
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