CID 94557768

1820571-47-8

Structural Information

Molecular Formula

C₇H₁₃N

SMILES

C1CC1[C@@H]2C[C@H]2CN

InChI

InChI=1S/C7H13N/c8-4-6-3-7(6)5-1-2-5/h5-7H,1-4,8H2/t6-,7-/m0/s1

InChIKey

BYYWMKYHSJUWJR-BQBZGAKWSA-N

Compound name

[(1R,2S)-2-cyclopropylcyclopropyl]methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 111.1048 Da
Monoisotopic Mass: 1.0
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]+	112.11208	105.9
[M+Na]+	134.09402	117.6
[M+NH4]+	129.13862	115.2
[M+K]+	150.06796	116.7
[M-H]-	110.09752	120.7
[M+Na-2H]-	132.07947	117.7
[M]+	111.10425	113.5
[M]-	111.10535	113.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.