CID 144668

74701-47-6

Structural Information

Molecular Formula

C₁₀H₁₅N

SMILES

CCC1=NC(=CC=C1)C(C)C

InChI

InChI=1S/C10H15N/c1-4-9-6-5-7-10(11-9)8(2)3/h5-8H,4H2,1-3H3

InChIKey

FBJCTMMJWADBLG-UHFFFAOYSA-N

Compound name

2-ethyl-6-propan-2-ylpyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 232
Patents: 149.12045 Da
Monoisotopic Mass: 2.8
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]+	150.12773	132.3
[M+Na]+	172.10967	140.1
[M-H]-	148.11317	134.7
[M+NH4]+	167.15427	152.7
[M+K]+	188.08361	138.4
[M+H-H2O]+	132.11771	126.1
[M+HCOO]-	194.11865	154.3
[M+CH3COO]-	208.13430	179.1
[M+Na-2H]-	170.09512	138.3
[M]+	149.11990	132.9
[M]-	149.12100	132.9

Literature stripe

literature stripe

Patent stripe

patents stripe