CID 40424054

886362-96-5

Structural Information

Molecular Formula
C15H22N2O2
SMILES
CN(CCN1CCCC1)C(=O)OCC2=CC=CC=C2
InChI
InChI=1S/C15H22N2O2/c1-16(11-12-17-9-5-6-10-17)15(18)19-13-14-7-3-2-4-8-14/h2-4,7-8H,5-6,9-13H2,1H3
InChIKey
JGABXAAXTUOSNH-UHFFFAOYSA-N
Compound name
benzyl N-methyl-N-(2-pyrrolidin-1-ylethyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.16812 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.17540 163.6
[M+Na]+ 285.15734 166.8
[M-H]- 261.16084 169.1
[M+NH4]+ 280.20194 180.3
[M+K]+ 301.13128 165.5
[M+H-H2O]+ 245.16538 154.7
[M+HCOO]- 307.16632 185.4
[M+CH3COO]- 321.18197 199.2
[M+Na-2H]- 283.14279 165.0
[M]+ 262.16757 163.3
[M]- 262.16867 163.3
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.