CID 282489

N-methyl-1-phenylcyclopentanecarboxamide

Structural Information

Molecular Formula
C13H17NO
SMILES
CNC(=O)C1(CCCC1)C2=CC=CC=C2
InChI
InChI=1S/C13H17NO/c1-14-12(15)13(9-5-6-10-13)11-7-3-2-4-8-11/h2-4,7-8H,5-6,9-10H2,1H3,(H,14,15)
InChIKey
WVSDQRXMAMFRGL-UHFFFAOYSA-N
Compound name
N-methyl-1-phenylcyclopentane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

2
Patents

203.13101 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.13829 147.2
[M+Na]+ 226.12023 152.3
[M-H]- 202.12373 153.4
[M+NH4]+ 221.16483 169.2
[M+K]+ 242.09417 149.7
[M+H-H2O]+ 186.12827 140.9
[M+HCOO]- 248.12921 170.3
[M+CH3COO]- 262.14486 185.3
[M+Na-2H]- 224.10568 151.5
[M]+ 203.13046 143.4
[M]- 203.13156 143.4
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