CID 9589181

126164-64-5

Structural Information

Molecular Formula
C12H15N3O2
SMILES
C1C(CN(C1=O)C/C(=N/O)/N)C2=CC=CC=C2
InChI
InChI=1S/C12H15N3O2/c13-11(14-17)8-15-7-10(6-12(15)16)9-4-2-1-3-5-9/h1-5,10,17H,6-8H2,(H2,13,14)
InChIKey
WVAIQPKVELLTLT-UHFFFAOYSA-N
Compound name
N'-hydroxy-2-(2-oxo-4-phenylpyrrolidin-1-yl)ethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

233.11642 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.123696 151.7
[M+Na]+ 256.105638 157.3
[M-H]- 232.109144 156.5
[M+NH4]+ 251.150243 168.8
[M+K]+ 272.079578 154.3
[M+H-H2O]+ 216.113680 143.7
[M+HCOO]- 278.114621 174.6
[M+CH3COO]- 292.130271 193.5
[M+Na-2H]- 254.091086 153.7
[M]+ 233.11587142 147.6
[M]- 233.11696858 147.6
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.