CID 3506204

2,2'-{[9-(hydroxyimino)-9h-fluorene-2,7-diyl]bis(oxy)}diacetic acid

Structural Information

Molecular Formula
C17H13NO7
SMILES
C1=CC2=C(C=C1OCC(=O)O)C(=NO)C3=C2C=CC(=C3)OCC(=O)O
InChI
InChI=1S/C17H13NO7/c19-15(20)7-24-9-1-3-11-12-4-2-10(25-8-16(21)22)6-14(12)17(18-23)13(11)5-9/h1-6,23H,7-8H2,(H,19,20)(H,21,22)
InChIKey
VOKATEXROYSXDW-UHFFFAOYSA-N
Compound name
2-[7-(carboxymethoxy)-9-hydroxyiminofluoren-2-yl]oxyacetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

343.0692 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.07648 171.5
[M+Na]+ 366.05842 178.8
[M-H]- 342.06192 174.7
[M+NH4]+ 361.10302 186.7
[M+K]+ 382.03236 176.3
[M+H-H2O]+ 326.06646 165.2
[M+HCOO]- 388.06740 191.3
[M+CH3COO]- 402.08305 209.6
[M+Na-2H]- 364.04387 174.7
[M]+ 343.06865 176.3
[M]- 343.06975 176.3
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

No patent data available for this compound.