CID 58380

N-(1-(1-adamantyl)hexyl)formamide

Structural Information

Molecular Formula
C17H29NO
SMILES
CCCCCC(C12CC3CC(C1)CC(C3)C2)NC=O
InChI
InChI=1S/C17H29NO/c1-2-3-4-5-16(18-12-19)17-9-13-6-14(10-17)8-15(7-13)11-17/h12-16H,2-11H2,1H3,(H,18,19)
InChIKey
AENKDSUMRCXPDY-UHFFFAOYSA-N
Compound name
N-[1-(1-adamantyl)hexyl]formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.2249 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.232176 167.5
[M+Na]+ 286.214118 166.7
[M-H]- 262.217624 161.5
[M+NH4]+ 281.258723 190.4
[M+K]+ 302.188058 162.9
[M+H-H2O]+ 246.222160 160.7
[M+HCOO]- 308.223101 173.3
[M+CH3COO]- 322.238751 173.9
[M+Na-2H]- 284.199566 175.4
[M]+ 263.22435142 167.6
[M]- 263.22544858 167.6
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.