CID 459103

Benzoxazolylnaphthalenol

Structural Information

Molecular Formula
C17H11NO2
SMILES
C1=CC=C2C(=C1)C=CC(=C2O)C3=NC4=CC=CC=C4O3
InChI
InChI=1S/C17H11NO2/c19-16-12-6-2-1-5-11(12)9-10-13(16)17-18-14-7-3-4-8-15(14)20-17/h1-10,19H
InChIKey
CZFZPDYIIZTJOR-UHFFFAOYSA-N
Compound name
2-(1,3-benzoxazol-2-yl)naphthalen-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

38
Patents

261.07898 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.08626 155.9
[M+Na]+ 284.06820 167.4
[M-H]- 260.07170 163.7
[M+NH4]+ 279.11280 173.3
[M+K]+ 300.04214 162.5
[M+H-H2O]+ 244.07624 148.3
[M+HCOO]- 306.07718 177.6
[M+CH3COO]- 320.09283 169.4
[M+Na-2H]- 282.05365 164.4
[M]+ 261.07843 159.0
[M]- 261.07953 159.0
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

patents stripe