CID 29002995

2-(tert-butoxy)ethanimidamide hydrochloride

Structural Information

Molecular Formula

C₆H₁₄N₂O

SMILES

CC(C)(C)OCC(=N)N

InChI

InChI=1S/C6H14N2O/c1-6(2,3)9-4-5(7)8/h4H2,1-3H3,(H3,7,8)

InChIKey

JOYDCDBZLFXIEK-UHFFFAOYSA-N

Compound name

2-[(2-methylpropan-2-yl)oxy]ethanimidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 9
Patents: 130.11061 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]+	131.117886	129.4
[M+Na]+	153.099828	135.5
[M-H]-	129.103334	129.4
[M+NH4]+	148.144433	150.7
[M+K]+	169.073768	135.5
[M+H-H2O]+	113.107870	124.8
[M+HCOO]-	175.108811	152.4
[M+CH3COO]-	189.124461	177.7
[M+Na-2H]-	151.085276	135.1
[M]+	130.11006142	127.5
[M]-	130.11115858	127.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe