CID 130515305

1-cyclopropylcycloheptan-1-amine

Structural Information

Molecular Formula

C₁₀H₁₉N

SMILES

C1CCCC(CC1)(C2CC2)N

InChI

InChI=1S/C10H19N/c11-10(9-5-6-9)7-3-1-2-4-8-10/h9H,1-8,11H2

InChIKey

OLBKNMZHDLJIOW-UHFFFAOYSA-N

Compound name

1-cyclopropylcycloheptan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 153.15175 Da
Monoisotopic Mass: 2.2
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]+	154.15903	126.9
[M+Na]+	176.14097	130.4
[M-H]-	152.14447	133.8
[M+NH4]+	171.18557	142.7
[M+K]+	192.11491	132.9
[M+H-H2O]+	136.14901	121.6
[M+HCOO]-	198.14995	146.5
[M+CH3COO]-	212.16560	183.1
[M+Na-2H]-	174.12642	132.4
[M]+	153.15120	120.0
[M]-	153.15230	120.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe