CID 1632712

303102-34-3

Structural Information

Molecular Formula
C28H27N3
SMILES
C1CN(CCN1CC2=CC=CC3=CC=CC=C32)N=CC4=CC=C(C=C4)C5=CC=CC=C5
InChI
InChI=1S/C28H27N3/c1-2-7-24(8-3-1)25-15-13-23(14-16-25)21-29-31-19-17-30(18-20-31)22-27-11-6-10-26-9-4-5-12-28(26)27/h1-16,21H,17-20,22H2
InChIKey
BALHNVSZUFSSKM-UHFFFAOYSA-N
Compound name
N-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]-1-(4-phenylphenyl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

405.2205 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 406.22778 202.2
[M+Na]+ 428.20972 205.8
[M-H]- 404.21322 211.8
[M+NH4]+ 423.25432 209.6
[M+K]+ 444.18366 196.8
[M+H-H2O]+ 388.21776 187.4
[M+HCOO]- 450.21870 218.9
[M+CH3COO]- 464.23435 209.1
[M+Na-2H]- 426.19517 205.9
[M]+ 405.21995 196.6
[M]- 405.22105 196.6
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.