CID 131697828

2167346-89-4

Structural Information

Molecular Formula
C9H16N2
SMILES
C1CN(CCN1)C23CC(C2)C3
InChI
InChI=1S/C9H16N2/c1-3-11(4-2-10-1)9-5-8(6-9)7-9/h8,10H,1-7H2
InChIKey
FVGWKOUTWIUQRL-UHFFFAOYSA-N
Compound name
1-(1-bicyclo[1.1.1]pentanyl)piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

152.13135 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.138626 141.7
[M+Na]+ 175.120568 144.5
[M-H]- 151.124074 143.1
[M+NH4]+ 170.165173 144.8
[M+K]+ 191.094508 149.8
[M+H-H2O]+ 135.128610 126.0
[M+HCOO]- 197.129551 150.5
[M+CH3COO]- 211.145201 203.7
[M+Na-2H]- 173.106016 148.1
[M]+ 152.13080142 161.2
[M]- 152.13189858 161.2
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