CID 104037065

1566229-02-4

Structural Information

Molecular Formula
C8H9F3N2O
SMILES
CC(C(F)(F)F)OC1=CC(=NC=C1)N
InChI
InChI=1S/C8H9F3N2O/c1-5(8(9,10)11)14-6-2-3-13-7(12)4-6/h2-5H,1H3,(H2,12,13)
InChIKey
ADOXWNWNWJTEFW-UHFFFAOYSA-N
Compound name
4-(1,1,1-trifluoropropan-2-yloxy)pyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

206.0667 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.07398 139.8
[M+Na]+ 229.05592 148.1
[M-H]- 205.05942 138.0
[M+NH4]+ 224.10052 157.0
[M+K]+ 245.02986 146.0
[M+H-H2O]+ 189.06396 130.9
[M+HCOO]- 251.06490 158.3
[M+CH3COO]- 265.08055 187.0
[M+Na-2H]- 227.04137 144.8
[M]+ 206.06615 135.2
[M]- 206.06725 135.2
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