CID 80170

N-hydroxysuccinimide

Structural Information

Molecular Formula
C4H5NO3
SMILES
C1CC(=O)N(C1=O)O
InChI
InChI=1S/C4H5NO3/c6-3-1-2-4(7)5(3)8/h8H,1-2H2
InChIKey
NQTADLQHYWFPDB-UHFFFAOYSA-N
Compound name
1-hydroxypyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

458
References

30838
Patents

115.02694 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.034216 117.6
[M+Na]+ 138.016158 126.9
[M-H]- 114.019664 119.1
[M+NH4]+ 133.060763 140.2
[M+K]+ 153.990098 126.2
[M+H-H2O]+ 98.024200 112.8
[M+HCOO]- 160.025141 139.9
[M+CH3COO]- 174.040791 163.6
[M+Na-2H]- 136.001606 122.4
[M]+ 115.02639142 115.8
[M]- 115.02748858 115.8
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