CID 86260350

926319-54-2

Structural Information

Molecular Formula
C13H19NO2
SMILES
CC(=O)NC(C)(C)CC1=CC=C(C=C1)OC
InChI
InChI=1S/C13H19NO2/c1-10(15)14-13(2,3)9-11-5-7-12(16-4)8-6-11/h5-8H,9H2,1-4H3,(H,14,15)
InChIKey
DDQHQQRZYRDMQX-UHFFFAOYSA-N
Compound name
N-[1-(4-methoxyphenyl)-2-methylpropan-2-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

221.14159 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.148866 151.5
[M+Na]+ 244.130808 157.8
[M-H]- 220.134314 155.1
[M+NH4]+ 239.175413 169.9
[M+K]+ 260.104748 156.3
[M+H-H2O]+ 204.138850 145.5
[M+HCOO]- 266.139791 173.9
[M+CH3COO]- 280.155441 193.1
[M+Na-2H]- 242.116256 156.7
[M]+ 221.14104142 153.5
[M]- 221.14213858 153.5
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