CID 516772

1,6-methanonaphthalene-1(2h)-carboxamide, octahydro-

Structural Information

Molecular Formula

C₁₂H₁₉NO

SMILES

C1CC2CC3CCC2C(C1)(C3)C(=O)N

InChI

InChI=1S/C12H19NO/c13-11(14)12-5-1-2-9-6-8(7-12)3-4-10(9)12/h8-10H,1-7H2,(H2,13,14)

InChIKey

OAXXKHFZMFHVTI-UHFFFAOYSA-N

Compound name

tricyclo[5.3.1.03,8]undecane-3-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 193.14667 Da
Monoisotopic Mass: 2.4
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]+	194.153946	142.1
[M+Na]+	216.135888	144.2
[M-H]-	192.139394	139.6
[M+NH4]+	211.180493	167.0
[M+K]+	232.109828	141.2
[M+H-H2O]+	176.143930	136.2
[M+HCOO]-	238.144871	151.0
[M+CH3COO]-	252.160521	151.5
[M+Na-2H]-	214.121336	150.6
[M]+	193.14612142	137.2
[M]-	193.14721858	137.2

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.