CID 58834

101737-54-6

Structural Information

Molecular Formula
C18H24N2
SMILES
CC1=CC(=CC(=N1)C)C(CCN(C)C)C2=CC=CC=C2
InChI
InChI=1S/C18H24N2/c1-14-12-17(13-15(2)19-14)18(10-11-20(3)4)16-8-6-5-7-9-16/h5-9,12-13,18H,10-11H2,1-4H3
InChIKey
MIWMXHBIPQPCHM-UHFFFAOYSA-N
Compound name
3-(2,6-dimethylpyridin-4-yl)-N,N-dimethyl-3-phenylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.19394 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.20122 166.5
[M+Na]+ 291.18316 172.2
[M-H]- 267.18666 172.8
[M+NH4]+ 286.22776 182.0
[M+K]+ 307.15710 169.0
[M+H-H2O]+ 251.19120 157.3
[M+HCOO]- 313.19214 188.7
[M+CH3COO]- 327.20779 208.1
[M+Na-2H]- 289.16861 169.5
[M]+ 268.19339 168.2
[M]- 268.19449 168.2
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.