CID 145913269

2378501-55-2

Structural Information

Molecular Formula
C7H12FN
SMILES
C1CNC12CC(C2)CF
InChI
InChI=1S/C7H12FN/c8-5-6-3-7(4-6)1-2-9-7/h6,9H,1-5H2
InChIKey
POUJVPMUMVTUEJ-UHFFFAOYSA-N
Compound name
6-(fluoromethyl)-1-azaspiro[3.3]heptane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

129.09538 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.10266 120.5
[M+Na]+ 152.08460 125.6
[M-H]- 128.08810 122.4
[M+NH4]+ 147.12920 129.6
[M+K]+ 168.05854 128.9
[M+H-H2O]+ 112.09264 106.9
[M+HCOO]- 174.09358 136.3
[M+CH3COO]- 188.10923 182.9
[M+Na-2H]- 150.07005 127.1
[M]+ 129.09483 132.0
[M]- 129.09593 132.0
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.