CID 59685082

Tert-butyl n-(2-methyl-1-phenylpropan-2-yl)carbamate

Structural Information

Molecular Formula
C15H23NO2
SMILES
CC(C)(C)OC(=O)NC(C)(C)CC1=CC=CC=C1
InChI
InChI=1S/C15H23NO2/c1-14(2,3)18-13(17)16-15(4,5)11-12-9-7-6-8-10-12/h6-10H,11H2,1-5H3,(H,16,17)
InChIKey
DVFAZVFWSKZADL-UHFFFAOYSA-N
Compound name
tert-butyl N-(2-methyl-1-phenylpropan-2-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

249.17288 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.180156 160.8
[M+Na]+ 272.162098 165.9
[M-H]- 248.165604 164.1
[M+NH4]+ 267.206703 178.0
[M+K]+ 288.136038 164.4
[M+H-H2O]+ 232.170140 154.9
[M+HCOO]- 294.171081 181.0
[M+CH3COO]- 308.186731 197.1
[M+Na-2H]- 270.147546 166.5
[M]+ 249.17233142 162.5
[M]- 249.17342858 162.5
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