CID 11819042

849149-67-3

Structural Information

Molecular Formula

C₄H₁₀N₂

SMILES

C1CC1(CN)N

InChI

InChI=1S/C4H10N2/c5-3-4(6)1-2-4/h1-3,5-6H2

InChIKey

JATTWGKYNBEIMH-UHFFFAOYSA-N

Compound name

1-(aminomethyl)cyclopropan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 172
Patents: 86.0844 Da
Monoisotopic Mass: -1.3
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]+	87.091676	113.6
[M+Na]+	109.07362	122.8
[M-H]-	85.077124	118.0
[M+NH4]+	104.11822	133.4
[M+K]+	125.04756	121.6
[M+H-H2O]+	69.081660	109.4
[M+HCOO]-	131.08260	138.9
[M+CH3COO]-	145.09825	171.2
[M+Na-2H]-	107.05907	122.1
[M]+	86.083851	112.5
[M]-	86.084949	112.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe