CID 64571942

1423031-69-9

Structural Information

Molecular Formula

C₁₀H₁₅ClN₂O

SMILES

CCC(C)(COC1=C(C=CC=N1)Cl)N

InChI

InChI=1S/C10H15ClN2O/c1-3-10(2,12)7-14-9-8(11)5-4-6-13-9/h4-6H,3,7,12H2,1-2H3

InChIKey

KXWMMKQZRYVDAL-UHFFFAOYSA-N

Compound name

1-[(3-chloro-2-pyridinyl)oxy]-2-methylbutan-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 214.0873 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]+	215.094576	147.3
[M+Na]+	237.076518	155.6
[M-H]-	213.080024	149.1
[M+NH4]+	232.121123	165.3
[M+K]+	253.050458	151.8
[M+H-H2O]+	197.084560	141.5
[M+HCOO]-	259.085501	164.7
[M+CH3COO]-	273.101151	188.4
[M+Na-2H]-	235.061966	153.7
[M]+	214.08675142	149.6
[M]-	214.08784858	149.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.