CID 668297

27466-85-9

Structural Information

Molecular Formula
C18H15NO
SMILES
C1=CC=C(C=C1)CNC(=O)C2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C18H15NO/c20-18(19-13-14-7-2-1-3-8-14)17-12-6-10-15-9-4-5-11-16(15)17/h1-12H,13H2,(H,19,20)
InChIKey
BLJPNWILUJTDPJ-UHFFFAOYSA-N
Compound name
N-benzylnaphthalene-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

261.11536 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.12264 159.1
[M+Na]+ 284.10458 165.5
[M-H]- 260.10808 166.3
[M+NH4]+ 279.14918 176.0
[M+K]+ 300.07852 160.3
[M+H-H2O]+ 244.11262 150.8
[M+HCOO]- 306.11356 182.3
[M+CH3COO]- 320.12921 170.9
[M+Na-2H]- 282.09003 166.7
[M]+ 261.11481 157.9
[M]- 261.11591 157.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe