CID 46362

64011-94-5

Structural Information

Molecular Formula
C8H18N2
SMILES
C1C[C@H]([C@@H]1CCN)CCN
InChI
InChI=1S/C8H18N2/c9-5-3-7-1-2-8(7)4-6-10/h7-8H,1-6,9-10H2/t7-,8-/m0/s1
InChIKey
UPHOTCOTHJGYEE-YUMQZZPRSA-N
Compound name
2-[(1S,2S)-2-(2-aminoethyl)cyclobutyl]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

142.147 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.154276 135.5
[M+Na]+ 165.136218 139.1
[M-H]- 141.139724 137.6
[M+NH4]+ 160.180823 149.5
[M+K]+ 181.110158 140.7
[M+H-H2O]+ 125.144260 124.1
[M+HCOO]- 187.145201 157.3
[M+CH3COO]- 201.160851 184.0
[M+Na-2H]- 163.121666 138.5
[M]+ 142.14645142 139.9
[M]- 142.14754858 139.9
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.