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

8
Patents

152.13135 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.13863 141.7
[M+Na]+ 175.12057 144.5
[M-H]- 151.12407 143.1
[M+NH4]+ 170.16517 144.8
[M+K]+ 191.09451 149.8
[M+H-H2O]+ 135.12861 126.0
[M+HCOO]- 197.12955 150.5
[M+CH3COO]- 211.14520 203.7
[M+Na-2H]- 173.10602 148.1
[M]+ 152.13080 161.2
[M]- 152.13190 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