CID 6474290

Chembl67543

Structural Information

Molecular Formula
C27H25N
SMILES
CN(CC1=CC=C(C=C1)/C=C/C2=CC=CC=C2)CC3=CC=CC4=CC=CC=C43
InChI
InChI=1S/C27H25N/c1-28(21-26-12-7-11-25-10-5-6-13-27(25)26)20-24-18-16-23(17-19-24)15-14-22-8-3-2-4-9-22/h2-19H,20-21H2,1H3/b15-14+
InChIKey
HQMGVVPNLBMWSO-CCEZHUSRSA-N
Compound name
N-methyl-N-(naphthalen-1-ylmethyl)-1-[4-[(E)-2-phenylethenyl]phenyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

363.1987 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.20598 192.0
[M+Na]+ 386.18792 196.8
[M-H]- 362.19142 202.3
[M+NH4]+ 381.23252 204.7
[M+K]+ 402.16186 189.3
[M+H-H2O]+ 346.19596 180.7
[M+HCOO]- 408.19690 214.2
[M+CH3COO]- 422.21255 201.4
[M+Na-2H]- 384.17337 196.4
[M]+ 363.19815 191.5
[M]- 363.19925 191.5
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.