CID 43146564

1782115-12-1

Structural Information

Molecular Formula

C₁₀H₁₁F₂NO

SMILES

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

InChI

InChI=1S/C10H11F2NO/c11-9(12)14-8-3-1-7(2-4-8)10(13)5-6-10/h1-4,9H,5-6,13H2

InChIKey

SKGCVNGTTQXVFI-UHFFFAOYSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 199.08087 Da
Monoisotopic Mass: 2.0
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]+	200.08815	134.8
[M+Na]+	222.07009	144.2
[M-H]-	198.07359	139.7
[M+NH4]+	217.11469	150.5
[M+K]+	238.04403	141.6
[M+H-H2O]+	182.07813	127.4
[M+HCOO]-	244.07907	156.9
[M+CH3COO]-	258.09472	189.0
[M+Na-2H]-	220.05554	140.6
[M]+	199.08032	134.0
[M]-	199.08142	134.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe