CID 564473

N-phenylcyclopentanecarboxamide

Structural Information

Molecular Formula
C12H15NO
SMILES
C1CCC(C1)C(=O)NC2=CC=CC=C2
InChI
InChI=1S/C12H15NO/c14-12(10-6-4-5-7-10)13-11-8-2-1-3-9-11/h1-3,8-10H,4-7H2,(H,13,14)
InChIKey
FRABTSINMBZPJB-UHFFFAOYSA-N
Compound name
N-phenylcyclopentanecarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

78
Patents

189.11537 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.12265 142.5
[M+Na]+ 212.10459 147.0
[M-H]- 188.10809 148.5
[M+NH4]+ 207.14919 163.0
[M+K]+ 228.07853 144.5
[M+H-H2O]+ 172.11263 135.7
[M+HCOO]- 234.11357 166.0
[M+CH3COO]- 248.12922 182.8
[M+Na-2H]- 210.09004 146.3
[M]+ 189.11482 138.1
[M]- 189.11592 138.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe