CID 26900

Brn 2137835

Structural Information

Molecular Formula
C19H32N2O
SMILES
CC(C)C(CCN(C)C)(C1=CC=C(C=C1)C(C)(C)C)C(=O)N
InChI
InChI=1S/C19H32N2O/c1-14(2)19(17(20)22,12-13-21(6)7)16-10-8-15(9-11-16)18(3,4)5/h8-11,14H,12-13H2,1-7H3,(H2,20,22)
InChIKey
XANOHBFYBJHVGC-UHFFFAOYSA-N
Compound name
2-(4-tert-butylphenyl)-2-[2-(dimethylamino)ethyl]-3-methylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

304.25146 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.25874 177.8
[M+Na]+ 327.24068 181.0
[M-H]- 303.24418 181.6
[M+NH4]+ 322.28528 192.9
[M+K]+ 343.21462 179.8
[M+H-H2O]+ 287.24872 171.2
[M+HCOO]- 349.24966 196.3
[M+CH3COO]- 363.26531 218.2
[M+Na-2H]- 325.22613 178.2
[M]+ 304.25091 178.9
[M]- 304.25201 178.9
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.