CID 4007480

2-(2,2-dimethylpropyl)pyrrolidine

Structural Information

Molecular Formula
C9H19N
SMILES
CC(C)(C)CC1CCCN1
InChI
InChI=1S/C9H19N/c1-9(2,3)7-8-5-4-6-10-8/h8,10H,4-7H2,1-3H3
InChIKey
BNQWNEMIHJZPIZ-UHFFFAOYSA-N
Compound name
2-(2,2-dimethylpropyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

124
Patents

141.15175 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.159026 136.0
[M+Na]+ 164.140968 141.4
[M-H]- 140.144474 136.1
[M+NH4]+ 159.185573 157.5
[M+K]+ 180.114908 139.7
[M+H-H2O]+ 124.149010 130.6
[M+HCOO]- 186.149951 153.9
[M+CH3COO]- 200.165601 171.9
[M+Na-2H]- 162.126416 139.9
[M]+ 141.15120142 131.7
[M]- 141.15229858 131.7
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