CID 58317634

2703392-34-9

Structural Information

Molecular Formula
C5H10F2N2
SMILES
C1[C@H]([C@H](CC1(F)F)N)N
InChI
InChI=1S/C5H10F2N2/c6-5(7)1-3(8)4(9)2-5/h3-4H,1-2,8-9H2/t3-,4+
InChIKey
YJBRVDQGZSWPGB-ZXZARUISSA-N
Compound name
cis-(1R,2S)-4,4-difluorocyclopentane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

136.0812 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.088476 122.5
[M+Na]+ 159.070418 130.5
[M-H]- 135.073924 122.9
[M+NH4]+ 154.115023 147.1
[M+K]+ 175.044358 128.7
[M+H-H2O]+ 119.078460 116.6
[M+HCOO]- 181.079401 144.7
[M+CH3COO]- 195.095051 175.7
[M+Na-2H]- 157.055866 125.9
[M]+ 136.08065142 113.8
[M]- 136.08174858 113.8
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