CID 110737495

Methyl n-[(1-methylpyrrolidin-3-yl)methyl]carbamate

Structural Information

Molecular Formula
C8H16N2O2
SMILES
CN1CCC(C1)CNC(=O)OC
InChI
InChI=1S/C8H16N2O2/c1-10-4-3-7(6-10)5-9-8(11)12-2/h7H,3-6H2,1-2H3,(H,9,11)
InChIKey
UZHXYEKZEWNCCL-UHFFFAOYSA-N
Compound name
methyl N-[(1-methylpyrrolidin-3-yl)methyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

172.12119 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.128466 139.2
[M+Na]+ 195.110408 144.9
[M-H]- 171.113914 141.0
[M+NH4]+ 190.155013 159.7
[M+K]+ 211.084348 144.7
[M+H-H2O]+ 155.118450 132.6
[M+HCOO]- 217.119391 161.2
[M+CH3COO]- 231.135041 180.4
[M+Na-2H]- 193.095856 142.0
[M]+ 172.12064142 138.0
[M]- 172.12173858 138.0
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.