CID 7138275

116763-69-0

Structural Information

Molecular Formula

C₈H₂₀N₂O₂

SMILES

COCCN(CCN)CCOC

InChI

InChI=1S/C8H20N2O2/c1-11-7-5-10(4-3-9)6-8-12-2/h3-9H2,1-2H3

InChIKey

QFKPHGNNLPBQDI-UHFFFAOYSA-N

Compound name

N',N'-bis(2-methoxyethyl)ethane-1,2-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 20
Patents: 176.15248 Da
Monoisotopic Mass: -1.0
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]+	177.159756	142.1
[M+Na]+	199.141698	146.8
[M-H]-	175.145204	142.7
[M+NH4]+	194.186303	162.1
[M+K]+	215.115638	147.9
[M+H-H2O]+	159.149740	135.7
[M+HCOO]-	221.150681	167.5
[M+CH3COO]-	235.166331	189.7
[M+Na-2H]-	197.127146	146.6
[M]+	176.15193142	145.6
[M]-	176.15302858	145.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe