CID 26167

13657-37-9

Structural Information

Molecular Formula
C23H33N
SMILES
CCCCN(CCCC)CCC(C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C23H33N/c1-3-5-18-24(19-6-4-2)20-17-23(21-13-9-7-10-14-21)22-15-11-8-12-16-22/h7-16,23H,3-6,17-20H2,1-2H3
InChIKey
DDHWFSVTAQZPAD-UHFFFAOYSA-N
Compound name
N-butyl-N-(3,3-diphenylpropyl)butan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

323.2613 Da
Monoisotopic Mass

6.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.26858 185.9
[M+Na]+ 346.25052 187.5
[M-H]- 322.25402 191.8
[M+NH4]+ 341.29512 199.7
[M+K]+ 362.22446 183.1
[M+H-H2O]+ 306.25856 176.2
[M+HCOO]- 368.25950 207.6
[M+CH3COO]- 382.27515 218.1
[M+Na-2H]- 344.23597 187.3
[M]+ 323.26075 187.9
[M]- 323.26185 187.9
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.