CID 53408547

(cycloheptylmethyl)(methyl)amine hydrochloride

Structural Information

Molecular Formula

C₉H₁₉N

SMILES

CNCC1CCCCCC1

InChI

InChI=1S/C9H19N/c1-10-8-9-6-4-2-3-5-7-9/h9-10H,2-8H2,1H3

InChIKey

PQPLDGDDBKJURL-UHFFFAOYSA-N

Compound name

1-cycloheptyl-N-methylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 13
Patents: 141.15175 Da
Monoisotopic Mass: 2.7
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]+	142.15903	130.6
[M+Na]+	164.14097	138.5
[M+NH4]+	159.18557	139.1
[M+K]+	180.11491	133.6
[M-H]-	140.14447	133.2
[M+Na-2H]-	162.12642	136.3
[M]+	141.15120	132.3
[M]-	141.15230	132.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe