CID 145913205

2378507-30-1

Structural Information

Molecular Formula
C7H12F3NO
SMILES
COC1(CC(C1)CN)C(F)(F)F
InChI
InChI=1S/C7H12F3NO/c1-12-6(7(8,9)10)2-5(3-6)4-11/h5H,2-4,11H2,1H3
InChIKey
QNIMDUHTQRGXIF-UHFFFAOYSA-N
Compound name
[3-methoxy-3-(trifluoromethyl)cyclobutyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.0871 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.09438 138.6
[M+Na]+ 206.07632 145.1
[M-H]- 182.07982 138.2
[M+NH4]+ 201.12092 153.6
[M+K]+ 222.05026 146.8
[M+H-H2O]+ 166.08436 127.4
[M+HCOO]- 228.08530 156.2
[M+CH3COO]- 242.10095 186.2
[M+Na-2H]- 204.06177 143.0
[M]+ 183.08655 142.0
[M]- 183.08765 142.0
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.