CID 3085673

72010-26-5

Structural Information

Molecular Formula
C22H30N2
SMILES
CCCCCC1=CC=C(C=C1)C=NNCC2=CC=C(C=C2)CCC
InChI
InChI=1S/C22H30N2/c1-3-5-6-8-20-11-15-22(16-12-20)18-24-23-17-21-13-9-19(7-4-2)10-14-21/h9-16,18,23H,3-8,17H2,1-2H3
InChIKey
TVVVXBDADDEUML-UHFFFAOYSA-N
Compound name
N-[(4-pentylphenyl)methylideneamino]-1-(4-propylphenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

322.2409 Da
Monoisotopic Mass

7.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.24818 182.4
[M+Na]+ 345.23012 186.5
[M-H]- 321.23362 189.2
[M+NH4]+ 340.27472 196.8
[M+K]+ 361.20406 180.8
[M+H-H2O]+ 305.23816 172.9
[M+HCOO]- 367.23910 207.8
[M+CH3COO]- 381.25475 219.2
[M+Na-2H]- 343.21557 185.9
[M]+ 322.24035 184.7
[M]- 322.24145 184.7
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.