CID 4132834

N-(4-chlorobenzyl)-1-naphthamide

Structural Information

Molecular Formula
C18H14ClNO
SMILES
C1=CC=C2C(=C1)C=CC=C2C(=O)NCC3=CC=C(C=C3)Cl
InChI
InChI=1S/C18H14ClNO/c19-15-10-8-13(9-11-15)12-20-18(21)17-7-3-5-14-4-1-2-6-16(14)17/h1-11H,12H2,(H,20,21)
InChIKey
JTOKHCCLFPKMFM-UHFFFAOYSA-N
Compound name
N-[(4-chlorophenyl)methyl]naphthalene-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.0764 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.08368 166.4
[M+Na]+ 318.06562 174.6
[M-H]- 294.06912 173.7
[M+NH4]+ 313.11022 183.1
[M+K]+ 334.03956 167.7
[M+H-H2O]+ 278.07366 159.0
[M+HCOO]- 340.07460 185.1
[M+CH3COO]- 354.09025 178.1
[M+Na-2H]- 316.05107 172.7
[M]+ 295.07585 168.1
[M]- 295.07695 168.1
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.