CID 146035805

2137997-74-9

Structural Information

Molecular Formula
C11H18F2N2O2
SMILES
CC(C)(C)OC(=O)N1CC2(C1)CNCC2(F)F
InChI
InChI=1S/C11H18F2N2O2/c1-9(2,3)17-8(16)15-6-10(7-15)4-14-5-11(10,12)13/h14H,4-7H2,1-3H3
InChIKey
DOGQPOKUZVLPJP-UHFFFAOYSA-N
Compound name
tert-butyl 5,5-difluoro-2,7-diazaspiro[3.4]octane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

248.13364 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.14092 157.6
[M+Na]+ 271.12286 163.7
[M-H]- 247.12636 156.9
[M+NH4]+ 266.16746 171.3
[M+K]+ 287.09680 164.3
[M+H-H2O]+ 231.13090 147.1
[M+HCOO]- 293.13184 169.5
[M+CH3COO]- 307.14749 190.8
[M+Na-2H]- 269.10831 160.1
[M]+ 248.13309 161.4
[M]- 248.13419 161.4
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

patents stripe