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]+ 174.12370 137.2
[M+Na]+ 196.10564 143.0
[M-H]- 172.10914 138.6
[M+NH4]+ 191.15024 155.0
[M+K]+ 212.07958 143.4
[M+H-H2O]+ 156.11368 129.2
[M+HCOO]- 218.11462 158.6
[M+CH3COO]- 232.13027 183.6
[M+Na-2H]- 194.09109 143.6
[M]+ 173.11587 136.8
[M]- 173.11697 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.