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

27
Patents

164.13135 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.138626 136.7
[M+Na]+ 187.120568 144.0
[M-H]- 163.124074 141.7
[M+NH4]+ 182.165173 157.8
[M+K]+ 203.094508 142.9
[M+H-H2O]+ 147.128610 130.5
[M+HCOO]- 209.129551 162.8
[M+CH3COO]- 223.145201 189.2
[M+Na-2H]- 185.106016 141.7
[M]+ 164.13080142 136.5
[M]- 164.13189858 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