CID 96878

N-methylcyclodecanamine

Structural Information

Molecular Formula

C₁₁H₂₃N

SMILES

CNC1CCCCCCCCC1

InChI

InChI=1S/C11H23N/c1-12-11-9-7-5-3-2-4-6-8-10-11/h11-12H,2-10H2,1H3

InChIKey

BOYGZZJDNIMQTC-UHFFFAOYSA-N

Compound name

N-methylcyclodecanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 55
Patents: 169.18304 Da
Monoisotopic Mass: 2.9
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]+	170.190316	139.8
[M+Na]+	192.172258	141.7
[M-H]-	168.175764	139.2
[M+NH4]+	187.216863	157.0
[M+K]+	208.146198	141.3
[M+H-H2O]+	152.180300	136.7
[M+HCOO]-	214.181241	158.5
[M+CH3COO]-	228.196891	177.7
[M+Na-2H]-	190.157706	143.1
[M]+	169.18249142	129.5
[M]-	169.18358858	129.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe