CID 22366497

2-methyl-2-phenylpiperidine

Structural Information

Molecular Formula
C12H17N
SMILES
CC1(CCCCN1)C2=CC=CC=C2
InChI
InChI=1S/C12H17N/c1-12(9-5-6-10-13-12)11-7-3-2-4-8-11/h2-4,7-8,13H,5-6,9-10H2,1H3
InChIKey
FLNODMVWOCAIEF-UHFFFAOYSA-N
Compound name
2-methyl-2-phenylpiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
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 140.9
[M+Na]+ 198.12532 145.8
[M-H]- 174.12882 144.0
[M+NH4]+ 193.16992 160.5
[M+K]+ 214.09926 142.3
[M+H-H2O]+ 158.13336 133.8
[M+HCOO]- 220.13430 158.9
[M+CH3COO]- 234.14995 152.4
[M+Na-2H]- 196.11077 147.5
[M]+ 175.13555 133.8
[M]- 175.13665 133.8
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