CID 12315

N-methylpropylamine

Structural Information

Molecular Formula

C₄H₁₁N

SMILES

CCCNC

InChI

InChI=1S/C4H11N/c1-3-4-5-2/h5H,3-4H2,1-2H3

InChIKey

GVWISOJSERXQBM-UHFFFAOYSA-N

Compound name

N-methylpropan-1-amine

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 3
References: 22480
Patents: 73.08915 Da
Monoisotopic Mass: 0.8
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]+	74.096426	112.8
[M+Na]+	96.078368	123.5
[M+NH4]+	91.122973	122.0
[M+K]+	112.05231	117.4
[M-H]-	72.081874	113.8
[M+Na-2H]-	94.063816	118.3
[M]+	73.088601	114.4
[M]-	73.089699	114.4

Literature stripe

literature stripe

Patent stripe

patents stripe