CID 53838

77944-89-9

Structural Information

Molecular Formula
C14H19ClN2O2
SMILES
CC1=C(C(=CC=C1)Cl)NC(=O)OCCN2CCCC2
InChI
InChI=1S/C14H19ClN2O2/c1-11-5-4-6-12(15)13(11)16-14(18)19-10-9-17-7-2-3-8-17/h4-6H,2-3,7-10H2,1H3,(H,16,18)
InChIKey
GWANHGPQNUKVGD-UHFFFAOYSA-N
Compound name
2-pyrrolidin-1-ylethyl N-(2-chloro-6-methylphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

282.1135 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.120776 166.0
[M+Na]+ 305.102718 172.2
[M-H]- 281.106224 170.8
[M+NH4]+ 300.147323 182.9
[M+K]+ 321.076658 167.8
[M+H-H2O]+ 265.110760 158.5
[M+HCOO]- 327.111701 183.0
[M+CH3COO]- 341.127351 198.8
[M+Na-2H]- 303.088166 166.8
[M]+ 282.11295142 167.0
[M]- 282.11404858 167.0
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.