CID 3057967

74332-79-9

Structural Information

Molecular Formula
C14H21N
SMILES
CC(C)C(C1=CC=CC=C1)N2CCCC2
InChI
InChI=1S/C14H21N/c1-12(2)14(15-10-6-7-11-15)13-8-4-3-5-9-13/h3-5,8-9,12,14H,6-7,10-11H2,1-2H3
InChIKey
GROSVIQDWQSINN-UHFFFAOYSA-N
Compound name
1-(2-methyl-1-phenylpropyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

203.1674 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.17468 150.2
[M+Na]+ 226.15662 154.1
[M-H]- 202.16012 154.5
[M+NH4]+ 221.20122 169.1
[M+K]+ 242.13056 151.7
[M+H-H2O]+ 186.16466 142.4
[M+HCOO]- 248.16560 169.1
[M+CH3COO]- 262.18125 187.1
[M+Na-2H]- 224.14207 151.2
[M]+ 203.16685 146.4
[M]- 203.16795 146.4
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

No patent data available for this compound.