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]+ 264.23218 167.5
[M+Na]+ 286.21412 166.7
[M-H]- 262.21762 161.5
[M+NH4]+ 281.25872 190.4
[M+K]+ 302.18806 162.9
[M+H-H2O]+ 246.22216 160.7
[M+HCOO]- 308.22310 173.3
[M+CH3COO]- 322.23875 173.9
[M+Na-2H]- 284.19957 175.4
[M]+ 263.22435 167.6
[M]- 263.22545 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.