CID 64153

1-acetamidoadamantane

Structural Information

Molecular Formula
C12H19NO
SMILES
CC(=O)NC12CC3CC(C1)CC(C3)C2
InChI
InChI=1S/C12H19NO/c1-8(14)13-12-5-9-2-10(6-12)4-11(3-9)7-12/h9-11H,2-7H2,1H3,(H,13,14)
InChIKey
BCVXYGJCDZPKGV-UHFFFAOYSA-N
Compound name
N-(1-adamantyl)acetamide
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

4
References

704
Patents

193.14667 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.15395 144.7
[M+Na]+ 216.13589 146.4
[M-H]- 192.13939 140.0
[M+NH4]+ 211.18049 170.7
[M+K]+ 232.10983 143.7
[M+H-H2O]+ 176.14393 139.0
[M+HCOO]- 238.14487 152.5
[M+CH3COO]- 252.16052 153.6
[M+Na-2H]- 214.12134 155.5
[M]+ 193.14612 143.5
[M]- 193.14722 143.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.