CID 117100547

1-(1-(difluoromethyl)cyclopropyl)-n-methylmethanamine hydrochloride

Structural Information

Molecular Formula
C6H11F2N
SMILES
CNCC1(CC1)C(F)F
InChI
InChI=1S/C6H11F2N/c1-9-4-6(2-3-6)5(7)8/h5,9H,2-4H2,1H3
InChIKey
QHCUJWVJSWIJRG-UHFFFAOYSA-N
Compound name
1-[1-(difluoromethyl)cyclopropyl]-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

135.08595 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 136.09323 122.1
[M+Na]+ 158.07517 130.8
[M-H]- 134.07867 124.4
[M+NH4]+ 153.11977 140.6
[M+K]+ 174.04911 129.7
[M+H-H2O]+ 118.08321 115.7
[M+HCOO]- 180.08415 144.0
[M+CH3COO]- 194.09980 179.8
[M+Na-2H]- 156.06062 129.0
[M]+ 135.08540 121.2
[M]- 135.08650 121.2
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.