CID 73999

N-hydroxypropyldiethylenetriamine

Structural Information

Molecular Formula

C₇H₁₉N₃O

SMILES

CCN(CC)NNCCCO

InChI

InChI=1S/C7H19N3O/c1-3-10(4-2)9-8-6-5-7-11/h8-9,11H,3-7H2,1-2H3

InChIKey

KGKKBNYECPRBFY-UHFFFAOYSA-N

Compound name

3-[2-(diethylamino)hydrazinyl]propan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 25
Patents: 161.15282 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]+	162.16010	138.1
[M+Na]+	184.14204	141.9
[M-H]-	160.14554	138.0
[M+NH4]+	179.18664	157.9
[M+K]+	200.11598	142.3
[M+H-H2O]+	144.15008	131.7
[M+HCOO]-	206.15102	163.7
[M+CH3COO]-	220.16667	187.8
[M+Na-2H]-	182.12749	143.9
[M]+	161.15227	138.0
[M]-	161.15337	138.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe