CID 165981586

2-(4-nitrosopiperazin-1-yl)-1-(pyrrolidin-1-yl)ethan-1-one

Structural Information

Molecular Formula
C10H18N4O2
SMILES
C1CCN(C1)C(=O)CN2CCN(CC2)N=O
InChI
InChI=1S/C10H18N4O2/c15-10(13-3-1-2-4-13)9-12-5-7-14(11-16)8-6-12/h1-9H2
InChIKey
TWEXLYXLHGSYJU-UHFFFAOYSA-N
Compound name
2-(4-nitrosopiperazin-1-yl)-1-pyrrolidin-1-ylethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.14297 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.15025 152.3
[M+Na]+ 249.13219 156.0
[M-H]- 225.13569 154.9
[M+NH4]+ 244.17679 167.6
[M+K]+ 265.10613 155.2
[M+H-H2O]+ 209.14023 142.4
[M+HCOO]- 271.14117 169.8
[M+CH3COO]- 285.15682 191.2
[M+Na-2H]- 247.11764 153.8
[M]+ 226.14242 147.3
[M]- 226.14352 147.3
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.