CID 61827644

3-amino-2,2-dimethyl-1-(pyrrolidin-1-yl)propan-1-one

Structural Information

Molecular Formula
C9H18N2O
SMILES
CC(C)(CN)C(=O)N1CCCC1
InChI
InChI=1S/C9H18N2O/c1-9(2,7-10)8(12)11-5-3-4-6-11/h3-7,10H2,1-2H3
InChIKey
XDKAYYVXGFABMZ-UHFFFAOYSA-N
Compound name
3-amino-2,2-dimethyl-1-pyrrolidin-1-ylpropan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

170.1419 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.14918 140.3
[M+Na]+ 193.13112 147.5
[M+NH4]+ 188.17572 147.4
[M+K]+ 209.10506 145.5
[M-H]- 169.13462 140.0
[M+Na-2H]- 191.11657 143.1
[M]+ 170.14135 140.8
[M]- 170.14245 140.8
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.