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]+ 233.165976 155.3
[M+Na]+ 255.147918 160.1
[M-H]- 231.151424 155.7
[M+NH4]+ 250.192523 173.5
[M+K]+ 271.121858 159.7
[M+H-H2O]+ 215.155960 148.3
[M+HCOO]- 277.156901 172.8
[M+CH3COO]- 291.172551 192.7
[M+Na-2H]- 253.133366 155.7
[M]+ 232.15815142 152.9
[M]- 232.15924858 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.