CID 22944288

[2-(dimethylamino)-2-phenylethyl](methyl)amine

Structural Information

Molecular Formula
C11H18N2
SMILES
CNCC(C1=CC=CC=C1)N(C)C
InChI
InChI=1S/C11H18N2/c1-12-9-11(13(2)3)10-7-5-4-6-8-10/h4-8,11-12H,9H2,1-3H3
InChIKey
ZMFAMENRGKQFSA-UHFFFAOYSA-N
Compound name
N,N,N'-trimethyl-1-phenylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

178.147 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.154276 142.0
[M+Na]+ 201.136218 146.7
[M-H]- 177.139724 146.6
[M+NH4]+ 196.180823 162.1
[M+K]+ 217.110158 146.1
[M+H-H2O]+ 161.144260 135.1
[M+HCOO]- 223.145201 167.5
[M+CH3COO]- 237.160851 191.5
[M+Na-2H]- 199.121666 147.7
[M]+ 178.14645142 141.8
[M]- 178.14754858 141.8
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