CID 9589179

126145-46-8

Structural Information

Molecular Formula
C13H17N3O2
SMILES
CC(/C(=N/O)/N)N1CC(CC1=O)C2=CC=CC=C2
InChI
InChI=1S/C13H17N3O2/c1-9(13(14)15-18)16-8-11(7-12(16)17)10-5-3-2-4-6-10/h2-6,9,11,18H,7-8H2,1H3,(H2,14,15)
InChIKey
JVPPCCMQAQXAPV-UHFFFAOYSA-N
Compound name
N'-hydroxy-2-(2-oxo-4-phenylpyrrolidin-1-yl)propanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

247.13208 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.13936 156.8
[M+Na]+ 270.12130 161.7
[M-H]- 246.12480 161.6
[M+NH4]+ 265.16590 173.3
[M+K]+ 286.09524 159.1
[M+H-H2O]+ 230.12934 148.8
[M+HCOO]- 292.13028 178.4
[M+CH3COO]- 306.14593 197.4
[M+Na-2H]- 268.10675 157.1
[M]+ 247.13153 152.4
[M]- 247.13263 152.4
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.