CID 155822382

Rac-(1r,2s)-2-(3,3-difluorocyclobutyl)cyclopropan-1-amine hydrochloride

Structural Information

Molecular Formula
C7H11F2N
SMILES
C1[C@H]([C@@H]1N)C2CC(C2)(F)F
InChI
InChI=1S/C7H11F2N/c8-7(9)2-4(3-7)5-1-6(5)10/h4-6H,1-3,10H2/t5-,6+/m0/s1
InChIKey
PPAIXWSUQGLJOF-NTSWFWBYSA-N
Compound name
(1R,2S)-2-(3,3-difluorocyclobutyl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

147.08595 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.09323 124.2
[M+Na]+ 170.07517 132.9
[M-H]- 146.07867 129.4
[M+NH4]+ 165.11977 136.3
[M+K]+ 186.04911 133.5
[M+H-H2O]+ 130.08321 113.4
[M+HCOO]- 192.08415 144.4
[M+CH3COO]- 206.09980 184.7
[M+Na-2H]- 168.06062 129.1
[M]+ 147.08540 129.7
[M]- 147.08650 129.7
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.