CID 24832219

Brn 2812126

Structural Information

Molecular Formula
C17H32N2O2
SMILES
CCN(CC)C(=O)CN(C)C1C2CCC(C1O)(C2(C)C)C
InChI
InChI=1S/C17H32N2O2/c1-7-19(8-2)13(20)11-18(6)14-12-9-10-17(5,15(14)21)16(12,3)4/h12,14-15,21H,7-11H2,1-6H3
InChIKey
NUIUTWUJJLSMAW-UHFFFAOYSA-N
Compound name
N,N-diethyl-2-[(3-hydroxy-4,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)-methylamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.24637 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.253646 173.4
[M+Na]+ 319.235588 178.5
[M-H]- 295.239094 177.2
[M+NH4]+ 314.280193 198.2
[M+K]+ 335.209528 177.6
[M+H-H2O]+ 279.243630 170.1
[M+HCOO]- 341.244571 192.8
[M+CH3COO]- 355.260221 215.5
[M+Na-2H]- 317.221036 172.7
[M]+ 296.24582142 176.3
[M]- 296.24691858 176.3
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.