CID 165990770

Tert-butyl n-(5-bromo-2-methylpentan-2-yl)carbamate

Structural Information

Molecular Formula
C11H22BrNO2
SMILES
CC(C)(C)OC(=O)NC(C)(C)CCCBr
InChI
InChI=1S/C11H22BrNO2/c1-10(2,3)15-9(14)13-11(4,5)7-6-8-12/h6-8H2,1-5H3,(H,13,14)
InChIKey
BWZCZHAESAQHJU-UHFFFAOYSA-N
Compound name
tert-butyl N-(5-bromo-2-methylpentan-2-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

279.0834 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.090676 162.2
[M+Na]+ 302.072618 170.9
[M-H]- 278.076124 164.8
[M+NH4]+ 297.117223 181.9
[M+K]+ 318.046558 160.6
[M+H-H2O]+ 262.080660 162.1
[M+HCOO]- 324.081601 179.4
[M+CH3COO]- 338.097251 199.1
[M+Na-2H]- 300.058066 167.8
[M]+ 279.08285142 182.7
[M]- 279.08394858 182.7
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.