CID 51853

73622-64-7

Structural Information

Molecular Formula
C12H16F3N3O
SMILES
CC(CC1=CC(=CC=C1)C(F)(F)F)NCC(=O)NN
InChI
InChI=1S/C12H16F3N3O/c1-8(17-7-11(19)18-16)5-9-3-2-4-10(6-9)12(13,14)15/h2-4,6,8,17H,5,7,16H2,1H3,(H,18,19)
InChIKey
PKLCKOXENANWFU-UHFFFAOYSA-N
Compound name
2-[1-[3-(trifluoromethyl)phenyl]propan-2-ylamino]acetohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.12454 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.13182 160.0
[M+Na]+ 298.11376 164.9
[M-H]- 274.11726 158.9
[M+NH4]+ 293.15836 174.8
[M+K]+ 314.08770 162.0
[M+H-H2O]+ 258.12180 150.5
[M+HCOO]- 320.12274 179.6
[M+CH3COO]- 334.13839 206.0
[M+Na-2H]- 296.09921 162.2
[M]+ 275.12399 153.3
[M]- 275.12509 153.3
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.