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

227
Patents

158.1419 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.14918 138.2
[M+Na]+ 181.13112 142.4
[M-H]- 157.13462 136.2
[M+NH4]+ 176.17572 155.4
[M+K]+ 197.10506 140.9
[M+H-H2O]+ 141.13916 130.8
[M+HCOO]- 203.14010 154.7
[M+CH3COO]- 217.15575 174.2
[M+Na-2H]- 179.11657 143.3
[M]+ 158.14135 134.0
[M]- 158.14245 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