CID 3024588

Tr 312

Structural Information

Molecular Formula
C12H26N2O
SMILES
CC(C)(C)CC(C)(C)NC(=O)CN(C)C
InChI
InChI=1S/C12H26N2O/c1-11(2,3)9-12(4,5)13-10(15)8-14(6)7/h8-9H2,1-7H3,(H,13,15)
InChIKey
NOLLGYSPPHOPPV-UHFFFAOYSA-N
Compound name
2-(dimethylamino)-N-(2,4,4-trimethylpentan-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.20451 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.211786 154.7
[M+Na]+ 237.193728 159.1
[M-H]- 213.197234 156.2
[M+NH4]+ 232.238333 173.9
[M+K]+ 253.167668 159.9
[M+H-H2O]+ 197.201770 149.7
[M+HCOO]- 259.202711 175.5
[M+CH3COO]- 273.218361 199.8
[M+Na-2H]- 235.179176 158.7
[M]+ 214.20396142 156.9
[M]- 214.20505858 156.9
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.