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]+ 248.139356 156.8
[M+Na]+ 270.121298 161.7
[M-H]- 246.124804 161.6
[M+NH4]+ 265.165903 173.3
[M+K]+ 286.095238 159.1
[M+H-H2O]+ 230.129340 148.8
[M+HCOO]- 292.130281 178.4
[M+CH3COO]- 306.145931 197.4
[M+Na-2H]- 268.106746 157.1
[M]+ 247.13153142 152.4
[M]- 247.13262858 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.