CID 22485357

1-methoxypiperazine

Structural Information

Molecular Formula
C5H12N2O
SMILES
CON1CCNCC1
InChI
InChI=1S/C5H12N2O/c1-8-7-4-2-6-3-5-7/h6H,2-5H2,1H3
InChIKey
DGUWRXBLZVOIFX-UHFFFAOYSA-N
Compound name
1-methoxypiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

177
Patents

116.09496 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 117.10224 124.8
[M+Na]+ 139.08418 130.3
[M-H]- 115.08768 123.4
[M+NH4]+ 134.12878 143.7
[M+K]+ 155.05812 129.6
[M+H-H2O]+ 99.092220 118.0
[M+HCOO]- 161.09316 142.3
[M+CH3COO]- 175.10881 165.1
[M+Na-2H]- 137.06963 131.5
[M]+ 116.09441 119.5
[M]- 116.09551 119.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe