CID 3019741

84176-68-1

Structural Information

Molecular Formula

C₈H₂₀N₂O

SMILES

CN(C)CCCNCCOC

InChI

InChI=1S/C8H20N2O/c1-10(2)7-4-5-9-6-8-11-3/h9H,4-8H2,1-3H3

InChIKey

ZRBJURRZDDZZAK-UHFFFAOYSA-N

Compound name

N-(2-methoxyethyl)-N',N'-dimethylpropane-1,3-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 12
Patents: 160.15756 Da
Monoisotopic Mass: 0.0
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]+	161.164836	139.2
[M+Na]+	183.146778	143.9
[M-H]-	159.150284	140.4
[M+NH4]+	178.191383	160.2
[M+K]+	199.120718	145.0
[M+H-H2O]+	143.154820	133.1
[M+HCOO]-	205.155761	165.1
[M+CH3COO]-	219.171411	188.5
[M+Na-2H]-	181.132226	144.8
[M]+	160.15701142	142.3
[M]-	160.15810858	142.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe