CID 5405437

5043-64-1

Structural Information

Molecular Formula
C15H11NO3
SMILES
COC(=O)C1=CC=CC\2=C1C3=CC=CC=C3/C2=N/O
InChI
InChI=1S/C15H11NO3/c1-19-15(17)12-8-4-7-11-13(12)9-5-2-3-6-10(9)14(11)16-18/h2-8,18H,1H3/b16-14-
InChIKey
NGVLXRBIJYFIFM-PEZBUJJGSA-N
Compound name
methyl (9Z)-9-hydroxyiminofluorene-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

20
Patents

253.0739 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.08118 154.6
[M+Na]+ 276.06312 167.5
[M+NH4]+ 271.10772 163.3
[M+K]+ 292.03706 162.4
[M-H]- 252.06662 157.5
[M+Na-2H]- 274.04857 160.0
[M]+ 253.07335 157.1
[M]- 253.07445 157.1
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