CID 135770382

50886-62-9

Structural Information

Molecular Formula
C18H15N3O2
SMILES
C1=CC=C2C(=C1)C=CC(=C2/C=N/NC(=O)C3=CC=CC=C3N)O
InChI
InChI=1S/C18H15N3O2/c19-16-8-4-3-7-14(16)18(23)21-20-11-15-13-6-2-1-5-12(13)9-10-17(15)22/h1-11,22H,19H2,(H,21,23)/b20-11+
InChIKey
NFMZNLOLRGYQJB-RGVLZGJSSA-N
Compound name
2-amino-N-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

2
Patents

305.11642 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.12370 168.6
[M+Na]+ 328.10564 175.2
[M-H]- 304.10914 175.9
[M+NH4]+ 323.15024 183.1
[M+K]+ 344.07958 170.2
[M+H-H2O]+ 288.11368 159.8
[M+HCOO]- 350.11462 193.5
[M+CH3COO]- 364.13027 212.1
[M+Na-2H]- 326.09109 174.9
[M]+ 305.11587 166.6
[M]- 305.11697 166.6
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