CID 112756371

1820575-58-3

Structural Information

Molecular Formula
C11H21FN2O2
SMILES
CC(C)(C)OC(=O)N(C)C[C@@H]1C[C@@H](CN1)F
InChI
InChI=1S/C11H21FN2O2/c1-11(2,3)16-10(15)14(4)7-9-5-8(12)6-13-9/h8-9,13H,5-7H2,1-4H3/t8-,9-/m0/s1
InChIKey
ZOZVFOIWQOWAES-IUCAKERBSA-N
Compound name
tert-butyl N-[[(2S,4S)-4-fluoropyrrolidin-2-yl]methyl]-N-methylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.1587 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.16598 155.3
[M+Na]+ 255.14792 160.1
[M-H]- 231.15142 155.7
[M+NH4]+ 250.19252 173.5
[M+K]+ 271.12186 159.7
[M+H-H2O]+ 215.15596 148.3
[M+HCOO]- 277.15690 172.8
[M+CH3COO]- 291.17255 192.7
[M+Na-2H]- 253.13337 155.7
[M]+ 232.15815 152.9
[M]- 232.15925 152.9
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.