CID 24707088

3-(propan-2-yloxy)propanimidamide hydrochloride

Structural Information

Molecular Formula

C₆H₁₄N₂O

SMILES

CC(C)OCCC(=N)N

InChI

InChI=1S/C6H14N2O/c1-5(2)9-4-3-6(7)8/h5H,3-4H2,1-2H3,(H3,7,8)

InChIKey

OGHRVLDNKQZMLB-UHFFFAOYSA-N

Compound name

3-propan-2-yloxypropanimidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 130.11061 Da
Monoisotopic Mass: -0.2
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]+	131.11789	130.3
[M+Na]+	153.09983	135.5
[M-H]-	129.10333	130.0
[M+NH4]+	148.14443	151.3
[M+K]+	169.07377	135.6
[M+H-H2O]+	113.10787	124.9
[M+HCOO]-	175.10881	153.8
[M+CH3COO]-	189.12446	178.9
[M+Na-2H]-	151.08528	134.0
[M]+	130.11006	128.2
[M]-	130.11116	128.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe