CID 64498

N-(2-adamantyl)acetamide hydrochloride

Structural Information

Molecular Formula

C₁₂H₁₉NO

SMILES

CC(=O)NC1C2CC3CC(C2)CC1C3

InChI

InChI=1S/C12H19NO/c1-7(14)13-12-10-3-8-2-9(5-10)6-11(12)4-8/h8-12H,2-6H2,1H3,(H,13,14)

InChIKey

OFEZUSBZKMXQEU-UHFFFAOYSA-N

Compound name

N-(2-adamantyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 44
Patents: 193.14667 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]+	194.15395	140.5
[M+Na]+	216.13589	149.1
[M+NH4]+	211.18049	152.0
[M+K]+	232.10983	142.0
[M-H]-	192.13939	139.1
[M+Na-2H]-	214.12134	136.6
[M]+	193.14612	141.1
[M]-	193.14722	141.1

Literature stripe

literature stripe

Patent stripe

patents stripe