CID 19960570

N-methyl-1-phenylcyclopentan-1-amine

Structural Information

Molecular Formula
C12H17N
SMILES
CNC1(CCCC1)C2=CC=CC=C2
InChI
InChI=1S/C12H17N/c1-13-12(9-5-6-10-12)11-7-3-2-4-8-11/h2-4,7-8,13H,5-6,9-10H2,1H3
InChIKey
QYODCTDZVODBKC-UHFFFAOYSA-N
Compound name
N-methyl-1-phenylcyclopentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

175.1361 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.14338 139.3
[M+Na]+ 198.12532 144.8
[M-H]- 174.12882 145.6
[M+NH4]+ 193.16992 162.6
[M+K]+ 214.09926 142.0
[M+H-H2O]+ 158.13336 133.1
[M+HCOO]- 220.13430 163.4
[M+CH3COO]- 234.14995 181.1
[M+Na-2H]- 196.11077 145.4
[M]+ 175.13555 135.1
[M]- 175.13665 135.1
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