CID 2453601

N-butyl-2-(n'-hydroxycarbamimidoyl)acetamide

Structural Information

Molecular Formula
C7H15N3O2
SMILES
CCCCNC(=O)CC(=NO)N
InChI
InChI=1S/C7H15N3O2/c1-2-3-4-9-7(11)5-6(8)10-12/h12H,2-5H2,1H3,(H2,8,10)(H,9,11)
InChIKey
KYELVRYIHJBZBW-UHFFFAOYSA-N
Compound name
3-amino-N-butyl-3-hydroxyiminopropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

173.11642 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.123696 139.8
[M+Na]+ 196.105638 144.1
[M-H]- 172.109144 139.3
[M+NH4]+ 191.150243 158.7
[M+K]+ 212.079578 143.9
[M+H-H2O]+ 156.113680 133.5
[M+HCOO]- 218.114621 164.5
[M+CH3COO]- 232.130271 187.0
[M+Na-2H]- 194.091086 143.2
[M]+ 173.11587142 137.8
[M]- 173.11696858 137.8
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.