CID 109020

60813-12-9

Structural Information

Molecular Formula
C37H55N3
SMILES
CCCN(CCC)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(CCC)CCC)C3=CC=C(C=C3)N(CCC)CCC
InChI
InChI=1S/C37H55N3/c1-7-25-38(26-8-2)34-19-13-31(14-20-34)37(32-15-21-35(22-16-32)39(27-9-3)28-10-4)33-17-23-36(24-18-33)40(29-11-5)30-12-6/h13-24,37H,7-12,25-30H2,1-6H3
InChIKey
UXBWXMXAXJKBSA-UHFFFAOYSA-N
Compound name
4-[bis[4-(dipropylamino)phenyl]methyl]-N,N-dipropylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

217
Patents

541.4396 Da
Monoisotopic Mass

11.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 542.44688 250.5
[M+Na]+ 564.42882 261.9
[M+NH4]+ 559.47342 257.2
[M+K]+ 580.40276 250.2
[M-H]- 540.43232 260.0
[M+Na-2H]- 562.41427 258.7
[M]+ 541.43905 255.0
[M]- 541.44015 255.0
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

patents stripe