CID 80610301

1-(difluoromethyl)cyclopentan-1-amine hydrochloride

Structural Information

Molecular Formula
C6H11F2N
SMILES
C1CCC(C1)(C(F)F)N
InChI
InChI=1S/C6H11F2N/c7-5(8)6(9)3-1-2-4-6/h5H,1-4,9H2
InChIKey
NFURXEZDAFTNTF-UHFFFAOYSA-N
Compound name
1-(difluoromethyl)cyclopentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

135.08595 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 136.09323 125.8
[M+Na]+ 158.07517 132.1
[M-H]- 134.07867 126.0
[M+NH4]+ 153.11977 150.4
[M+K]+ 174.04911 131.0
[M+H-H2O]+ 118.08321 119.6
[M+HCOO]- 180.08415 146.3
[M+CH3COO]- 194.09980 173.1
[M+Na-2H]- 156.06062 129.2
[M]+ 135.08540 117.8
[M]- 135.08650 117.8
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