CID 57854

100427-88-1

Structural Information

Molecular Formula
C19H25N
SMILES
CCN(CC)C(CCC1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C19H25N/c1-3-20(4-2)19(18-13-9-6-10-14-18)16-15-17-11-7-5-8-12-17/h5-14,19H,3-4,15-16H2,1-2H3
InChIKey
KUPXJHZOBSBPRH-UHFFFAOYSA-N
Compound name
N,N-diethyl-1,3-diphenylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

267.1987 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.20598 167.4
[M+Na]+ 290.18792 170.8
[M-H]- 266.19142 174.2
[M+NH4]+ 285.23252 183.6
[M+K]+ 306.16186 167.4
[M+H-H2O]+ 250.19596 158.7
[M+HCOO]- 312.19690 190.6
[M+CH3COO]- 326.21255 206.2
[M+Na-2H]- 288.17337 171.1
[M]+ 267.19815 168.1
[M]- 267.19925 168.1
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.