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

3
Patents

203.13101 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.138286 147.2
[M+Na]+ 226.120228 152.3
[M-H]- 202.123734 153.4
[M+NH4]+ 221.164833 169.2
[M+K]+ 242.094168 149.7
[M+H-H2O]+ 186.128270 140.9
[M+HCOO]- 248.129211 170.3
[M+CH3COO]- 262.144861 185.3
[M+Na-2H]- 224.105676 151.5
[M]+ 203.13046142 143.4
[M]- 203.13155858 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