CID 548604

62581-60-6

Structural Information

Molecular Formula
C18H15NO
SMILES
CC1=CC=CC=C1N=CC2=C(C=CC3=CC=CC=C32)O
InChI
InChI=1S/C18H15NO/c1-13-6-2-5-9-17(13)19-12-16-15-8-4-3-7-14(15)10-11-18(16)20/h2-12,20H,1H3
InChIKey
DHMQBAZAQAXKEX-UHFFFAOYSA-N
Compound name
1-[(2-methylphenyl)iminomethyl]naphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

261.11536 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.12264 159.1
[M+Na]+ 284.10458 167.7
[M-H]- 260.10808 167.1
[M+NH4]+ 279.14918 176.7
[M+K]+ 300.07852 162.1
[M+H-H2O]+ 244.11262 151.1
[M+HCOO]- 306.11356 183.4
[M+CH3COO]- 320.12921 171.8
[M+Na-2H]- 282.09003 166.5
[M]+ 261.11481 159.4
[M]- 261.11591 159.4
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