CID 65528186

1955532-10-1

Structural Information

Molecular Formula
C11H17F3N2O
SMILES
C1CCC2(CC1)CNCCN2C(=O)C(F)(F)F
InChI
InChI=1S/C11H17F3N2O/c12-11(13,14)9(17)16-7-6-15-8-10(16)4-2-1-3-5-10/h15H,1-8H2
InChIKey
UDLHMYIYXQOIRQ-UHFFFAOYSA-N
Compound name
1-(1,4-diazaspiro[5.5]undecan-1-yl)-2,2,2-trifluoroethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

250.1293 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.13658 157.7
[M+Na]+ 273.11852 161.4
[M-H]- 249.12202 153.7
[M+NH4]+ 268.16312 173.0
[M+K]+ 289.09246 158.0
[M+H-H2O]+ 233.12656 147.8
[M+HCOO]- 295.12750 164.8
[M+CH3COO]- 309.14315 187.1
[M+Na-2H]- 271.10397 160.0
[M]+ 250.12875 143.3
[M]- 250.12985 143.3
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.