CID 460671

Chembl302922

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/c1-21(23-9-4-3-5-10-23)24-17-15-22(16-18-24)19-28(2)20-26-13-8-12-25-11-6-7-14-27(25)26/h3-18H,1,19-20H2,2H3
InChIKey
XFBVXOBXOQMAFI-UHFFFAOYSA-N
Compound name
N-methyl-N-(naphthalen-1-ylmethyl)-1-[4-(1-phenylethenyl)phenyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

363.1987 Da
Monoisotopic Mass

7.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.20598 191.8
[M+Na]+ 386.18792 196.2
[M-H]- 362.19142 202.2
[M+NH4]+ 381.23252 204.3
[M+K]+ 402.16186 189.2
[M+H-H2O]+ 346.19596 180.7
[M+HCOO]- 408.19690 212.9
[M+CH3COO]- 422.21255 201.1
[M+Na-2H]- 384.17337 195.1
[M]+ 363.19815 190.8
[M]- 363.19925 190.8
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.