CID 72219235

2-chloro-6-cyclopropoxypyrazine

Structural Information

Molecular Formula

C₇H₇ClN₂O

SMILES

C1CC1OC2=CN=CC(=N2)Cl

InChI

InChI=1S/C7H7ClN2O/c8-6-3-9-4-7(10-6)11-5-1-2-5/h3-5H,1-2H2

InChIKey

VLKBNMVPOBCHFK-UHFFFAOYSA-N

Compound name

2-chloro-6-cyclopropyloxypyrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 44
Patents: 170.02469 Da
Monoisotopic Mass: 2.2
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]+	171.03197	133.2
[M+Na]+	193.01391	149.2
[M+NH4]+	188.05851	142.7
[M+K]+	208.98785	143.5
[M-H]-	169.01741	142.6
[M+Na-2H]-	190.99936	144.4
[M]+	170.02414	139.5
[M]-	170.02524	139.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe