CID 66465760

1890053-25-4

Structural Information

Molecular Formula
C12H17N
SMILES
CC1=CC=CC=C1C2(CCCN2)C
InChI
InChI=1S/C12H17N/c1-10-6-3-4-7-11(10)12(2)8-5-9-13-12/h3-4,6-7,13H,5,8-9H2,1-2H3
InChIKey
UNGAYJKKNNKHJU-UHFFFAOYSA-N
Compound name
2-methyl-2-(2-methylphenyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
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 139.9
[M+Na]+ 198.12532 146.9
[M-H]- 174.12882 143.9
[M+NH4]+ 193.16992 161.9
[M+K]+ 214.09926 143.3
[M+H-H2O]+ 158.13336 133.6
[M+HCOO]- 220.13430 160.2
[M+CH3COO]- 234.14995 152.7
[M+Na-2H]- 196.11077 144.4
[M]+ 175.13555 135.6
[M]- 175.13665 135.6
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

No patent data available for this compound.