CID 53441115

3-(2-aminoethyl)cyclopentan-1-ol

Structural Information

Molecular Formula
C7H15NO
SMILES
C1CC(CC1CCN)O
InChI
InChI=1S/C7H15NO/c8-4-3-6-1-2-7(9)5-6/h6-7,9H,1-5,8H2
InChIKey
IPEJGMVVPMNACG-UHFFFAOYSA-N
Compound name
3-(2-aminoethyl)cyclopentan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

129.11537 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.122646 128.8
[M+Na]+ 152.104588 134.4
[M-H]- 128.108094 130.1
[M+NH4]+ 147.149193 151.4
[M+K]+ 168.078528 132.8
[M+H-H2O]+ 112.112630 123.7
[M+HCOO]- 174.113571 150.8
[M+CH3COO]- 188.129221 170.8
[M+Na-2H]- 150.090036 131.8
[M]+ 129.11482142 123.8
[M]- 129.11591858 123.8
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