CID 177801543

2-{bicyclo[2.1.1]hexan-1-yl}ethan-1-amine hydrochloride

Structural Information

Molecular Formula
C8H15N
SMILES
C1CC2(CC1C2)CCN
InChI
InChI=1S/C8H15N/c9-4-3-8-2-1-7(5-8)6-8/h7H,1-6,9H2
InChIKey
BMZVJRZJWCNDLR-UHFFFAOYSA-N
Compound name
2-(1-bicyclo[2.1.1]hexanyl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

125.12045 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.127726 134.5
[M+Na]+ 148.109668 140.0
[M-H]- 124.113174 135.3
[M+NH4]+ 143.154273 158.6
[M+K]+ 164.083608 140.6
[M+H-H2O]+ 108.117710 127.5
[M+HCOO]- 170.118651 153.5
[M+CH3COO]- 184.134301 179.3
[M+Na-2H]- 146.095116 142.0
[M]+ 125.11990142 144.5
[M]- 125.12099858 144.5
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

No patent data available for this compound.