CID 369197

Nsc640903

Structural Information

Molecular Formula
C19H29NO2
SMILES
CC(C)(C)C(C12C3C4C1C5C2C3C45C(=O)N(C)C(C)(C)C)O
InChI
InChI=1S/C19H29NO2/c1-16(2,3)14(21)18-8-11-9(18)13-10(18)12(8)19(11,13)15(22)20(7)17(4,5)6/h8-14,21H,1-7H3
InChIKey
DAACFRDEXNIXCF-UHFFFAOYSA-N
Compound name
N-tert-butyl-4-(1-hydroxy-2,2-dimethylpropyl)-N-methylcubane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.21982 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.22710 245.1
[M+Na]+ 326.20904 243.1
[M-H]- 302.21254 248.2
[M+NH4]+ 321.25364 239.1
[M+K]+ 342.18298 247.6
[M+H-H2O]+ 286.21708 232.2
[M+HCOO]- 348.21802 243.5
[M+CH3COO]- 362.23367 269.0
[M+Na-2H]- 324.19449 235.5
[M]+ 303.21927 264.0
[M]- 303.22037 264.0
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.