CID 136983610

2-[1-(hydroxyimino)-3-oxo-2,3-dihydro-1h-isoindol-2-yl]acetamide

Structural Information

Molecular Formula
C10H9N3O3
SMILES
C1=CC2=C(N(C(=C2C=C1)O)CC(=O)N)N=O
InChI
InChI=1S/C10H9N3O3/c11-8(14)5-13-9(12-16)6-3-1-2-4-7(6)10(13)15/h1-4,15H,5H2,(H2,11,14)
InChIKey
SFJBMHICUSTSQE-UHFFFAOYSA-N
Compound name
2-(1-hydroxy-3-nitrosoisoindol-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

219.06439 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.071666 142.5
[M+Na]+ 242.053608 152.8
[M-H]- 218.057114 146.7
[M+NH4]+ 237.098213 162.0
[M+K]+ 258.027548 150.3
[M+H-H2O]+ 202.061650 135.8
[M+HCOO]- 264.062591 169.0
[M+CH3COO]- 278.078241 192.4
[M+Na-2H]- 240.039056 148.6
[M]+ 219.06384142 145.3
[M]- 219.06493858 145.3
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.