CID 79093083

[2-amino-2-(oxan-4-yl)ethyl]dimethylamine

Structural Information

Molecular Formula

C₉H₂₀N₂O

SMILES

CN(C)CC(C1CCOCC1)N

InChI

InChI=1S/C9H20N2O/c1-11(2)7-9(10)8-3-5-12-6-4-8/h8-9H,3-7,10H2,1-2H3

InChIKey

ARLRTXZWQKMXDI-UHFFFAOYSA-N

Compound name

N',N'-dimethyl-1-(oxan-4-yl)ethane-1,2-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 172.15756 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]+	173.164836	142.8
[M+Na]+	195.146778	145.3
[M-H]-	171.150284	146.7
[M+NH4]+	190.191383	161.2
[M+K]+	211.120718	146.8
[M+H-H2O]+	155.154820	136.0
[M+HCOO]-	217.155761	163.1
[M+CH3COO]-	231.171411	187.9
[M+Na-2H]-	193.132226	146.2
[M]+	172.15701142	138.4
[M]-	172.15810858	138.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe