CID 135452548

Nsc639668

Structural Information

Molecular Formula
C15H10N2O3
SMILES
C1=CC=C2C(=C1)C(=O)N(C2=O)/N=C/C3=CC=C(C=C3)O
InChI
InChI=1S/C15H10N2O3/c18-11-7-5-10(6-8-11)9-16-17-14(19)12-3-1-2-4-13(12)15(17)20/h1-9,18H/b16-9+
InChIKey
UFAPHVMNWBAQAP-CXUHLZMHSA-N
Compound name
2-[(E)-(4-hydroxyphenyl)methylideneamino]isoindole-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

266.06915 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.07643 156.7
[M+Na]+ 289.05837 166.6
[M-H]- 265.06187 164.0
[M+NH4]+ 284.10297 174.6
[M+K]+ 305.03231 161.9
[M+H-H2O]+ 249.06641 149.0
[M+HCOO]- 311.06735 180.8
[M+CH3COO]- 325.08300 198.3
[M+Na-2H]- 287.04382 161.5
[M]+ 266.06860 157.8
[M]- 266.06970 157.8
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

No patent data available for this compound.