CID 558546

17397-13-6

Structural Information

Molecular Formula

C₆H₁₃N

SMILES

CC(C)(C1CC1)N

InChI

InChI=1S/C6H13N/c1-6(2,7)5-3-4-5/h5H,3-4,7H2,1-2H3

InChIKey

OOXIEUXBOSSXJM-UHFFFAOYSA-N

Compound name

2-cyclopropylpropan-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 546
Patents: 99.1048 Da
Monoisotopic Mass: 0.6
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]+	100.11208	119.2
[M+Na]+	122.09402	128.1
[M-H]-	98.097524	123.8
[M+NH4]+	117.13862	137.4
[M+K]+	138.06796	126.6
[M+H-H2O]+	82.102060	114.3
[M+HCOO]-	144.10300	142.4
[M+CH3COO]-	158.11865	173.7
[M+Na-2H]-	120.07947	126.9
[M]+	99.104251	119.6
[M]-	99.105349	119.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe