CID 11851334

459167-93-2

Structural Information

Molecular Formula
C3H8FN
SMILES
C[C@@H](CF)N
InChI
InChI=1S/C3H8FN/c1-3(5)2-4/h3H,2,5H2,1H3/t3-/m0/s1
InChIKey
IRQOJWDMOUIHNR-VKHMYHEASA-N
Compound name
(2S)-1-fluoropropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

283
Patents

77.06408 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 78.071356 112.4
[M+Na]+ 100.05330 119.7
[M-H]- 76.056804 111.3
[M+NH4]+ 95.097903 136.0
[M+K]+ 116.02724 120.0
[M+H-H2O]+ 60.061340 107.4
[M+HCOO]- 122.06228 135.4
[M+CH3COO]- 136.07793 165.7
[M+Na-2H]- 98.038746 118.4
[M]+ 77.063531 108.8
[M]- 77.064629 108.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe