CID 14578673

Tert-butyl n-(1-hydroxy-2-methylpropan-2-yl)carbamate

Structural Information

Molecular Formula
C9H19NO3
SMILES
CC(C)(C)OC(=O)NC(C)(C)CO
InChI
InChI=1S/C9H19NO3/c1-8(2,3)13-7(12)10-9(4,5)6-11/h11H,6H2,1-5H3,(H,10,12)
InChIKey
SBWYTQQSTIUXOP-UHFFFAOYSA-N
Compound name
tert-butyl N-(1-hydroxy-2-methylpropan-2-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

783
Patents

189.13649 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.143766 144.5
[M+Na]+ 212.125708 150.3
[M-H]- 188.129214 143.5
[M+NH4]+ 207.170313 163.6
[M+K]+ 228.099648 150.5
[M+H-H2O]+ 172.133750 140.5
[M+HCOO]- 234.134691 163.7
[M+CH3COO]- 248.150341 183.1
[M+Na-2H]- 210.111156 150.1
[M]+ 189.13594142 145.9
[M]- 189.13703858 145.9
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