CID 369193

Nsc640899

Structural Information

Molecular Formula
C20H30N2O2
SMILES
CC(C)(C)N(C)C(=O)C12C3C4C1C5C2C3C45C(=O)N(C)C(C)(C)C
InChI
InChI=1S/C20H30N2O2/c1-17(2,3)21(7)15(23)19-9-12-10(19)14-11(19)13(9)20(12,14)16(24)22(8)18(4,5)6/h9-14H,1-8H3
InChIKey
GWXNNJDKFDIEOX-UHFFFAOYSA-N
Compound name
1-N,4-N-ditert-butyl-1-N,4-N-dimethylcubane-1,4-dicarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

330.23074 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.23802 251.6
[M+Na]+ 353.21996 248.9
[M-H]- 329.22346 255.1
[M+NH4]+ 348.26456 245.3
[M+K]+ 369.19390 254.1
[M+H-H2O]+ 313.22800 237.7
[M+HCOO]- 375.22894 250.3
[M+CH3COO]- 389.24459 272.3
[M+Na-2H]- 351.20541 241.3
[M]+ 330.23019 270.6
[M]- 330.23129 270.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.