CID 59314

102366-84-7

Structural Information

Molecular Formula
C17H34N2O3
SMILES
CCCOC(CCC(=O)N)CC(=O)N(C(C)(C)C)C(C)(C)C
InChI
InChI=1S/C17H34N2O3/c1-8-11-22-13(9-10-14(18)20)12-15(21)19(16(2,3)4)17(5,6)7/h13H,8-12H2,1-7H3,(H2,18,20)
InChIKey
RLWIIYVWTBDSDN-UHFFFAOYSA-N
Compound name
N,N-ditert-butyl-3-propoxyhexanediamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

314.25696 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.26424 181.3
[M+Na]+ 337.24618 183.4
[M-H]- 313.24968 181.4
[M+NH4]+ 332.29078 195.9
[M+K]+ 353.22012 184.2
[M+H-H2O]+ 297.25422 175.4
[M+HCOO]- 359.25516 198.6
[M+CH3COO]- 373.27081 218.3
[M+Na-2H]- 335.23163 179.8
[M]+ 314.25641 185.1
[M]- 314.25751 185.1
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.