CID 3085676

72010-29-8

Structural Information

Molecular Formula
C25H36N2
SMILES
CCCCCCCCC1=CC=C(C=C1)C=NNCC2=CC=C(C=C2)CCC
InChI
InChI=1S/C25H36N2/c1-3-5-6-7-8-9-11-23-14-18-25(19-15-23)21-27-26-20-24-16-12-22(10-4-2)13-17-24/h12-19,21,26H,3-11,20H2,1-2H3
InChIKey
OTUQHPCOTMDXFW-UHFFFAOYSA-N
Compound name
N-[(4-octylphenyl)methylideneamino]-1-(4-propylphenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

364.28784 Da
Monoisotopic Mass

8.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.29512 195.8
[M+Na]+ 387.27706 198.5
[M-H]- 363.28056 201.9
[M+NH4]+ 382.32166 208.4
[M+K]+ 403.25100 192.1
[M+H-H2O]+ 347.28510 185.5
[M+HCOO]- 409.28604 220.1
[M+CH3COO]- 423.30169 228.1
[M+Na-2H]- 385.26251 197.6
[M]+ 364.28729 199.1
[M]- 364.28839 199.1
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.