CID 3086419

3-methylbicyclo(3.2.1)octane-3-carboxamide

Structural Information

Molecular Formula

C₁₀H₁₇NO

SMILES

CC1(CC2CCC(C2)C1)C(=O)N

InChI

InChI=1S/C10H17NO/c1-10(9(11)12)5-7-2-3-8(4-7)6-10/h7-8H,2-6H2,1H3,(H2,11,12)

InChIKey

CLUZEQJDEXSBNY-UHFFFAOYSA-N

Compound name

3-methylbicyclo[3.2.1]octane-3-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 167.13101 Da
Monoisotopic Mass: 1.9
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]+	168.13829	138.3
[M+Na]+	190.12023	146.3
[M+NH4]+	185.16483	149.0
[M+K]+	206.09417	140.7
[M-H]-	166.12373	139.3
[M+Na-2H]-	188.10568	141.2
[M]+	167.13046	139.5
[M]-	167.13156	139.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe