CID 132391453

2172602-36-5

Structural Information

Molecular Formula
C8H15F2NO
SMILES
CC(C1(CCOCC1)CN)(F)F
InChI
InChI=1S/C8H15F2NO/c1-7(9,10)8(6-11)2-4-12-5-3-8/h2-6,11H2,1H3
InChIKey
YUXXEBYBAATNQO-UHFFFAOYSA-N
Compound name
[4-(1,1-difluoroethyl)oxan-4-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.11217 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.119446 137.5
[M+Na]+ 202.101388 142.8
[M-H]- 178.104894 138.0
[M+NH4]+ 197.145993 157.4
[M+K]+ 218.075328 142.7
[M+H-H2O]+ 162.109430 131.2
[M+HCOO]- 224.110371 154.0
[M+CH3COO]- 238.126021 180.9
[M+Na-2H]- 200.086836 144.1
[M]+ 179.11162142 130.4
[M]- 179.11271858 130.4
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

No patent data available for this compound.