CID 137942375

3-(2-methylpropyl)bicyclo[1.1.1]pentan-1-amine hydrochloride

Structural Information

Molecular Formula
C9H17N
SMILES
CC(C)CC12CC(C1)(C2)N
InChI
InChI=1S/C9H17N/c1-7(2)3-8-4-9(10,5-8)6-8/h7H,3-6,10H2,1-2H3
InChIKey
BMBXJWIUNUJZKP-UHFFFAOYSA-N
Compound name
3-(2-methylpropyl)bicyclo[1.1.1]pentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

139.1361 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.14338 149.3
[M+Na]+ 162.12532 145.8
[M+NH4]+ 157.16992 149.7
[M+K]+ 178.09926 143.1
[M-H]- 138.12882 143.0
[M+Na-2H]- 160.11077 145.7
[M]+ 139.13555 144.4
[M]- 139.13665 144.4
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