CID 1822536

1-(3-methoxypropyl)piperazine

Structural Information

Molecular Formula
C8H18N2O
SMILES
COCCCN1CCNCC1
InChI
InChI=1S/C8H18N2O/c1-11-8-2-5-10-6-3-9-4-7-10/h9H,2-8H2,1H3
InChIKey
GWWCQKPWZIASLS-UHFFFAOYSA-N
Compound name
1-(3-methoxypropyl)piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

233
Patents

158.1419 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.149176 138.2
[M+Na]+ 181.131118 142.4
[M-H]- 157.134624 136.2
[M+NH4]+ 176.175723 155.4
[M+K]+ 197.105058 140.9
[M+H-H2O]+ 141.139160 130.8
[M+HCOO]- 203.140101 154.7
[M+CH3COO]- 217.155751 174.2
[M+Na-2H]- 179.116566 143.3
[M]+ 158.14135142 134.0
[M]- 158.14244858 134.0
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

patents stripe