CID 89176

N,n-dimethyl-3-(pyrrolidin-1-yl)propionamide

Structural Information

Molecular Formula
C9H18N2O
SMILES
CN(C)C(=O)CCN1CCCC1
InChI
InChI=1S/C9H18N2O/c1-10(2)9(12)5-8-11-6-3-4-7-11/h3-8H2,1-2H3
InChIKey
FPOIPGRFNPFJPZ-UHFFFAOYSA-N
Compound name
N,N-dimethyl-3-pyrrolidin-1-ylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

170.1419 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.14918 141.2
[M+Na]+ 193.13112 145.7
[M-H]- 169.13462 143.9
[M+NH4]+ 188.17572 162.1
[M+K]+ 209.10506 146.2
[M+H-H2O]+ 153.13916 134.1
[M+HCOO]- 215.14010 163.2
[M+CH3COO]- 229.15575 184.4
[M+Na-2H]- 191.11657 143.3
[M]+ 170.14135 139.9
[M]- 170.14245 139.9
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