CID 155858693

2580232-41-1

Structural Information

Molecular Formula
C7H14FNO
SMILES
COC1(CC(C1)CF)CN
InChI
InChI=1S/C7H14FNO/c1-10-7(5-9)2-6(3-7)4-8/h6H,2-5,9H2,1H3
InChIKey
MYRVEEKOBPRBAG-UHFFFAOYSA-N
Compound name
[3-(fluoromethyl)-1-methoxycyclobutyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

147.10594 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.11322 131.3
[M+Na]+ 170.09516 137.3
[M-H]- 146.09866 133.3
[M+NH4]+ 165.13976 147.8
[M+K]+ 186.06910 139.4
[M+H-H2O]+ 130.10320 121.4
[M+HCOO]- 192.10414 152.5
[M+CH3COO]- 206.11979 181.1
[M+Na-2H]- 168.08061 136.4
[M]+ 147.10539 137.8
[M]- 147.10649 137.8
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

No patent data available for this compound.