CID 68698319

4,4-dimethyl-2-phenylpyrrolidine hydrochloride

Structural Information

Molecular Formula

C₁₂H₁₇N

SMILES

CC1(CC(NC1)C2=CC=CC=C2)C

InChI

InChI=1S/C12H17N/c1-12(2)8-11(13-9-12)10-6-4-3-5-7-10/h3-7,11,13H,8-9H2,1-2H3

InChIKey

ZGBMJAZQZIZYTI-UHFFFAOYSA-N

Compound name

4,4-dimethyl-2-phenylpyrrolidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 20
Patents: 175.1361 Da
Monoisotopic Mass: 2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	176.14338	141.1
[M+Na]+	198.12532	153.4
[M+NH4]+	193.16992	152.0
[M+K]+	214.09926	145.8
[M-H]-	174.12882	144.7
[M+Na-2H]-	196.11077	149.9
[M]+	175.13555	144.0
[M]-	175.13665	144.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe