CID 114782803

1599396-58-3

Structural Information

Molecular Formula
C6H11F2NO
SMILES
C1C(CC1OC(F)F)CN
InChI
InChI=1S/C6H11F2NO/c7-6(8)10-5-1-4(2-5)3-9/h4-6H,1-3,9H2
InChIKey
LKSVUKDWRPZUMX-UHFFFAOYSA-N
Compound name
[3-(difluoromethoxy)cyclobutyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

151.08087 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.08815 130.6
[M+Na]+ 174.07009 135.8
[M-H]- 150.07359 131.0
[M+NH4]+ 169.11469 144.6
[M+K]+ 190.04403 138.2
[M+H-H2O]+ 134.07813 118.3
[M+HCOO]- 196.07907 150.0
[M+CH3COO]- 210.09472 182.1
[M+Na-2H]- 172.05554 133.1
[M]+ 151.08032 134.5
[M]- 151.08142 134.5
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.