CID 67118461

1200798-12-4

Structural Information

Molecular Formula

C₁₀H₁₀F₃NO

SMILES

C1CC1(C2=CC=C(C=C2)OC(F)(F)F)N

InChI

InChI=1S/C10H10F3NO/c11-10(12,13)15-8-3-1-7(2-4-8)9(14)5-6-9/h1-4H,5-6,14H2

InChIKey

FEYUYWNRWUVYDE-UHFFFAOYSA-N

Compound name

1-[4-(trifluoromethoxy)phenyl]cyclopropan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 24
Patents: 217.07144 Da
Monoisotopic Mass: 2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	218.07872	136.7
[M+Na]+	240.06066	146.7
[M-H]-	216.06416	140.4
[M+NH4]+	235.10526	151.9
[M+K]+	256.03460	143.8
[M+H-H2O]+	200.06870	128.8
[M+HCOO]-	262.06964	157.1
[M+CH3COO]-	276.08529	190.6
[M+Na-2H]-	238.04611	143.8
[M]+	217.07089	134.8
[M]-	217.07199	134.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe