CID 14130438

3-(aminomethyl)cyclopentan-1-ol

Structural Information

Molecular Formula
C6H13NO
SMILES
C1CC(CC1CN)O
InChI
InChI=1S/C6H13NO/c7-4-5-1-2-6(8)3-5/h5-6,8H,1-4,7H2
InChIKey
NUBNZASXRSXFRW-UHFFFAOYSA-N
Compound name
3-(aminomethyl)cyclopentan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

96
Patents

115.09972 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.106996 124.2
[M+Na]+ 138.088938 130.3
[M-H]- 114.092444 125.7
[M+NH4]+ 133.133543 147.4
[M+K]+ 154.062878 128.9
[M+H-H2O]+ 98.096980 119.3
[M+HCOO]- 160.097921 146.6
[M+CH3COO]- 174.113571 167.7
[M+Na-2H]- 136.074386 127.8
[M]+ 115.09917142 118.9
[M]- 115.10026858 118.9
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

patents stripe