CID 58073

P-methylbenzyl n-(2-pyrrolidinylethyl)carbamate hydrochloride

Structural Information

Molecular Formula
C15H22N2O2
SMILES
CC1=CC=C(C=C1)COC(=O)NCCN2CCCC2
InChI
InChI=1S/C15H22N2O2/c1-13-4-6-14(7-5-13)12-19-15(18)16-8-11-17-9-2-3-10-17/h4-7H,2-3,8-12H2,1H3,(H,16,18)
InChIKey
APRYUDLHPDPKKY-UHFFFAOYSA-N
Compound name
(4-methylphenyl)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

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.17540 164.2
[M+Na]+ 285.15734 173.6
[M+NH4]+ 280.20194 171.3
[M+K]+ 301.13128 168.9
[M-H]- 261.16084 166.8
[M+Na-2H]- 283.14279 169.5
[M]+ 262.16757 165.9
[M]- 262.16867 165.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.