CID 20345950

55699-13-3

Structural Information

Molecular Formula
C14H21NO2
SMILES
CC1=CC(=C(C(=C1CC(=O)N)C)O)C(C)(C)C
InChI
InChI=1S/C14H21NO2/c1-8-6-11(14(3,4)5)13(17)9(2)10(8)7-12(15)16/h6,17H,7H2,1-5H3,(H2,15,16)
InChIKey
SZXVVIYVCJXDSD-UHFFFAOYSA-N
Compound name
2-(4-tert-butyl-3-hydroxy-2,6-dimethylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

235.15723 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.16451 155.3
[M+Na]+ 258.14645 163.5
[M-H]- 234.14995 158.0
[M+NH4]+ 253.19105 173.1
[M+K]+ 274.12039 160.8
[M+H-H2O]+ 218.15449 150.3
[M+HCOO]- 280.15543 175.1
[M+CH3COO]- 294.17108 196.7
[M+Na-2H]- 256.13190 156.4
[M]+ 235.15668 155.9
[M]- 235.15778 155.9
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

patents stripe