CID 6483891

145689-96-9

Structural Information

Molecular Formula

C₆H₁₀N₂O

SMILES

CCC1=NOC(=C1)CN

InChI

InChI=1S/C6H10N2O/c1-2-5-3-6(4-7)9-8-5/h3H,2,4,7H2,1H3

InChIKey

LZSPQVFNMYRNEU-UHFFFAOYSA-N

Compound name

(3-ethyl-1,2-oxazol-5-yl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 46
Patents: 126.079315 Da
Monoisotopic Mass: 0.1
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]+	127.08659	124.1
[M+Na]+	149.06853	135.1
[M+NH4]+	144.11314	132.3
[M+K]+	165.04247	132.0
[M-H]-	125.07204	126.7
[M+Na-2H]-	147.05398	129.4
[M]+	126.07877	126.2
[M]-	126.07986	126.2

Literature stripe

literature stripe

Patent stripe

patents stripe