CID 3043626

55875-62-2

Structural Information

Molecular Formula
C13H22N2
SMILES
CCN(CC)C1=CC=C(C=C1)CC(C)N
InChI
InChI=1S/C13H22N2/c1-4-15(5-2)13-8-6-12(7-9-13)10-11(3)14/h6-9,11H,4-5,10,14H2,1-3H3
InChIKey
LZBBMATWNMHAKF-UHFFFAOYSA-N
Compound name
4-(2-aminopropyl)-N,N-diethylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.1783 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.18558 151.5
[M+Na]+ 229.16752 156.4
[M-H]- 205.17102 155.6
[M+NH4]+ 224.21212 170.5
[M+K]+ 245.14146 154.9
[M+H-H2O]+ 189.17556 144.5
[M+HCOO]- 251.17650 175.7
[M+CH3COO]- 265.19215 198.0
[M+Na-2H]- 227.15297 154.3
[M]+ 206.17775 151.4
[M]- 206.17885 151.4
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

No patent data available for this compound.