CID 165946582

1-(2-methoxyethyl)-4-nitrosopiperazine

Structural Information

Molecular Formula
C7H15N3O2
SMILES
COCCN1CCN(CC1)N=O
InChI
InChI=1S/C7H15N3O2/c1-12-7-6-9-2-4-10(8-11)5-3-9/h2-7H2,1H3
InChIKey
KQQIDZCVGCEKNG-UHFFFAOYSA-N
Compound name
1-(2-methoxyethyl)-4-nitrosopiperazine
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 137.2
[M+Na]+ 196.105638 143.0
[M-H]- 172.109144 138.6
[M+NH4]+ 191.150243 155.0
[M+K]+ 212.079578 143.4
[M+H-H2O]+ 156.113680 129.2
[M+HCOO]- 218.114621 158.6
[M+CH3COO]- 232.130271 183.6
[M+Na-2H]- 194.091086 143.6
[M]+ 173.11587142 136.8
[M]- 173.11696858 136.8
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.