CID 45088486

2,2-dimethyl-3-(pyrrolidin-1-yl)propan-1-amine

Structural Information

Molecular Formula
C9H20N2
SMILES
CC(C)(CN)CN1CCCC1
InChI
InChI=1S/C9H20N2/c1-9(2,7-10)8-11-5-3-4-6-11/h3-8,10H2,1-2H3
InChIKey
XETCAGQZWBVYMH-UHFFFAOYSA-N
Compound name
2,2-dimethyl-3-pyrrolidin-1-ylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

35
Patents

156.16264 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.169916 139.0
[M+Na]+ 179.151858 143.8
[M-H]- 155.155364 139.9
[M+NH4]+ 174.196463 159.8
[M+K]+ 195.125798 142.6
[M+H-H2O]+ 139.159900 132.8
[M+HCOO]- 201.160841 158.8
[M+CH3COO]- 215.176491 179.3
[M+Na-2H]- 177.137306 142.8
[M]+ 156.16209142 134.9
[M]- 156.16318858 134.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe