CID 559387

N-methyldipropylamine

Structural Information

Molecular Formula

C₇H₁₇N

SMILES

CCCN(C)CCC

InChI

InChI=1S/C7H17N/c1-4-6-8(3)7-5-2/h4-7H2,1-3H3

InChIKey

UVBMZKBIZUWTLV-UHFFFAOYSA-N

Compound name

N-methyl-N-propylpropan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4596
Patents: 115.1361 Da
Monoisotopic Mass: 2.1
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]+	116.14338	126.4
[M+Na]+	138.12532	136.7
[M+NH4]+	133.16992	135.4
[M+K]+	154.09926	130.5
[M-H]-	114.12882	127.7
[M+Na-2H]-	136.11077	131.3
[M]+	115.13555	128.1
[M]-	115.13665	128.1

Literature stripe

literature stripe

Patent stripe

patents stripe