CID 45791189

(2,2-dimethylcyclopropyl)methanamine hydrochloride

Structural Information

Molecular Formula

C₆H₁₃N

SMILES

CC1(CC1CN)C

InChI

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

InChIKey

FPMPHZAUZKHZNK-UHFFFAOYSA-N

Compound name

(2,2-dimethylcyclopropyl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 60
Patents: 99.1048 Da
Monoisotopic Mass: 0.9
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	119.1
[M+Na]+	122.09402	129.1
[M-H]-	98.097524	124.2
[M+NH4]+	117.13862	139.4
[M+K]+	138.06796	128.1
[M+H-H2O]+	82.102060	115.1
[M+HCOO]-	144.10300	143.4
[M+CH3COO]-	158.11865	174.1
[M+Na-2H]-	120.07947	126.6
[M]+	99.104251	120.7
[M]-	99.105349	120.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe