CID 409747

115151-94-5

Structural Information

Molecular Formula

C₆H₁₃N

SMILES

CC1CCCC1N

InChI

InChI=1S/C6H13N/c1-5-3-2-4-6(5)7/h5-6H,2-4,7H2,1H3

InChIKey

TYDMZADCGUWTCH-UHFFFAOYSA-N

Compound name

2-methylcyclopentan-1-amine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 829
Patents: 99.1048 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]+	100.11208	120.6
[M+Na]+	122.09402	127.1
[M-H]-	98.097524	123.6
[M+NH4]+	117.13862	145.2
[M+K]+	138.06796	126.3
[M+H-H2O]+	82.102060	115.7
[M+HCOO]-	144.10300	144.2
[M+CH3COO]-	158.11865	168.3
[M+Na-2H]-	120.07947	124.7
[M]+	99.104251	115.7
[M]-	99.105349	115.7

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.