CID 2735696

1-(butan-2-yl)piperazine

Structural Information

Molecular Formula
C8H18N2
SMILES
CCC(C)N1CCNCC1
InChI
InChI=1S/C8H18N2/c1-3-8(2)10-6-4-9-5-7-10/h8-9H,3-7H2,1-2H3
InChIKey
ZHHCLIRTNOSAPB-UHFFFAOYSA-N
Compound name
1-butan-2-ylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

341
Patents

142.147 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.15428 135.5
[M+Na]+ 165.13622 139.6
[M-H]- 141.13972 133.8
[M+NH4]+ 160.18082 153.4
[M+K]+ 181.11016 138.1
[M+H-H2O]+ 125.14426 128.5
[M+HCOO]- 187.14520 150.9
[M+CH3COO]- 201.16085 173.0
[M+Na-2H]- 163.12167 139.5
[M]+ 142.14645 129.2
[M]- 142.14755 129.2
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