CID 10997558

2-(4-aminophenyl)cyclopentan-1-one hydrochloride

Structural Information

Molecular Formula
C11H13NO
SMILES
C1CC(C(=O)C1)C2=CC=C(C=C2)N
InChI
InChI=1S/C11H13NO/c12-9-6-4-8(5-7-9)10-2-1-3-11(10)13/h4-7,10H,1-3,12H2
InChIKey
SEBZUMJKINAAEU-UHFFFAOYSA-N
Compound name
2-(4-aminophenyl)cyclopentan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

175.09972 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.10700 137.0
[M+Na]+ 198.08894 144.1
[M-H]- 174.09244 143.3
[M+NH4]+ 193.13354 158.4
[M+K]+ 214.06288 140.9
[M+H-H2O]+ 158.09698 130.8
[M+HCOO]- 220.09792 161.1
[M+CH3COO]- 234.11357 181.1
[M+Na-2H]- 196.07439 140.2
[M]+ 175.09917 132.7
[M]- 175.10027 132.7
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.