CID 5760311

Methyl 9-(hydroxyimino)-9h-fluorene-4-carboxylate

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-JQIJEIRASA-N
Compound name
methyl (9E)-9-hydroxyiminofluorene-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

21
Patents

253.0739 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.081176 153.5
[M+Na]+ 276.063118 163.0
[M-H]- 252.066624 159.7
[M+NH4]+ 271.107723 174.5
[M+K]+ 292.037058 159.3
[M+H-H2O]+ 236.071160 147.4
[M+HCOO]- 298.072101 177.5
[M+CH3COO]- 312.087751 196.9
[M+Na-2H]- 274.048566 159.5
[M]+ 253.07335142 156.4
[M]- 253.07444858 156.4
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