CID 145912885

2378502-88-4

Structural Information

Molecular Formula
C15H21FN2O2
SMILES
CC(C)(C)OC(=O)NC1(CCNC1)C2=CC(=CC=C2)F
InChI
InChI=1S/C15H21FN2O2/c1-14(2,3)20-13(19)18-15(7-8-17-10-15)11-5-4-6-12(16)9-11/h4-6,9,17H,7-8,10H2,1-3H3,(H,18,19)
InChIKey
MCHACKJXVNWYPF-UHFFFAOYSA-N
Compound name
tert-butyl N-[3-(3-fluorophenyl)pyrrolidin-3-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.1587 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.16598 165.9
[M+Na]+ 303.14792 173.6
[M+NH4]+ 298.19252 173.1
[M+K]+ 319.12186 169.0
[M-H]- 279.15142 165.8
[M+Na-2H]- 301.13337 171.5
[M]+ 280.15815 166.7
[M]- 280.15925 166.7
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.