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]+ 180.11945 137.5
[M+Na]+ 202.10139 142.8
[M-H]- 178.10489 138.0
[M+NH4]+ 197.14599 157.4
[M+K]+ 218.07533 142.7
[M+H-H2O]+ 162.10943 131.2
[M+HCOO]- 224.11037 154.0
[M+CH3COO]- 238.12602 180.9
[M+Na-2H]- 200.08684 144.1
[M]+ 179.11162 130.4
[M]- 179.11272 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.