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

833
Patents

189.13649 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.14377 144.5
[M+Na]+ 212.12571 150.3
[M-H]- 188.12921 143.5
[M+NH4]+ 207.17031 163.6
[M+K]+ 228.09965 150.5
[M+H-H2O]+ 172.13375 140.5
[M+HCOO]- 234.13469 163.7
[M+CH3COO]- 248.15034 183.1
[M+Na-2H]- 210.11116 150.1
[M]+ 189.13594 145.9
[M]- 189.13704 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