CID 79001580

2287287-03-8

Structural Information

Molecular Formula

C₇H₁₆N₂

SMILES

CN(C)CC1(CC1)CN

InChI

InChI=1S/C7H16N2/c1-9(2)6-7(5-8)3-4-7/h3-6,8H2,1-2H3

InChIKey

QOJIQNDDIYNVJK-UHFFFAOYSA-N

Compound name

[1-[(dimethylamino)methyl]cyclopropyl]methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 9
Patents: 128.13135 Da
Monoisotopic Mass: -0.1
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]+	129.13863	127.5
[M+Na]+	151.12057	135.5
[M-H]-	127.12407	133.2
[M+NH4]+	146.16517	146.6
[M+K]+	167.09451	135.3
[M+H-H2O]+	111.12861	122.5
[M+HCOO]-	173.12955	152.9
[M+CH3COO]-	187.14520	183.9
[M+Na-2H]-	149.10602	134.5
[M]+	128.13080	129.5
[M]-	128.13190	129.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe