CID 53974044

2-amino-1-cyclopentylethan-1-one hydrochloride

Structural Information

Molecular Formula
C7H13NO
SMILES
C1CCC(C1)C(=O)CN
InChI
InChI=1S/C7H13NO/c8-5-7(9)6-3-1-2-4-6/h6H,1-5,8H2
InChIKey
OFEWIJHAUCILQY-UHFFFAOYSA-N
Compound name
2-amino-1-cyclopentylethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

180
Patents

127.09972 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.106996 128.4
[M+Na]+ 150.088938 133.5
[M-H]- 126.092444 130.8
[M+NH4]+ 145.133543 151.3
[M+K]+ 166.062878 132.7
[M+H-H2O]+ 110.096980 122.9
[M+HCOO]- 172.097921 151.1
[M+CH3COO]- 186.113571 172.2
[M+Na-2H]- 148.074386 131.2
[M]+ 127.09917142 123.5
[M]- 127.10026858 123.5
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

patents stripe