CID 212875

25225-42-7

Structural Information

Molecular Formula
C17H30N2O
SMILES
CCN(CC)CCNC(=O)C12CC3CC(C1)CC(C3)C2
InChI
InChI=1S/C17H30N2O/c1-3-19(4-2)6-5-18-16(20)17-10-13-7-14(11-17)9-15(8-13)12-17/h13-15H,3-12H2,1-2H3,(H,18,20)
InChIKey
ZCWPLFSPERUBNW-UHFFFAOYSA-N
Compound name
N-[2-(diethylamino)ethyl]adamantane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

278.2358 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.24308 169.7
[M+Na]+ 301.22502 168.1
[M-H]- 277.22852 164.7
[M+NH4]+ 296.26962 192.2
[M+K]+ 317.19896 165.9
[M+H-H2O]+ 261.23306 162.7
[M+HCOO]- 323.23400 176.8
[M+CH3COO]- 337.24965 216.4
[M+Na-2H]- 299.21047 177.5
[M]+ 278.23525 170.2
[M]- 278.23635 170.2
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

patents stripe