CID 9588895

1-carbamidomethyl-2-carbamidoiminopyrrolidine chlorhydrate

Structural Information

Molecular Formula
C7H12N4O2
SMILES
C1C/C(=N\C(=O)N)/N(C1)CC(=O)N
InChI
InChI=1S/C7H12N4O2/c8-5(12)4-11-3-1-2-6(11)10-7(9)13/h1-4H2,(H2,8,12)(H2,9,13)/b10-6+
InChIKey
ANYYQWQPGMOHRM-UXBLZVDNSA-N
Compound name
2-[(2E)-2-carbamoyliminopyrrolidin-1-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

184.09602 Da
Monoisotopic Mass

-1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.10330 140.6
[M+Na]+ 207.08524 145.7
[M+NH4]+ 202.12984 146.0
[M+K]+ 223.05918 145.0
[M-H]- 183.08874 140.4
[M+Na-2H]- 205.07069 142.1
[M]+ 184.09547 140.3
[M]- 184.09657 140.3
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.