CID 66168502

Tert-butyl n-(2,3-dihydroxy-2-methylpropyl)carbamate

Structural Information

Molecular Formula
C9H19NO4
SMILES
CC(C)(C)OC(=O)NCC(C)(CO)O
InChI
InChI=1S/C9H19NO4/c1-8(2,3)14-7(12)10-5-9(4,13)6-11/h11,13H,5-6H2,1-4H3,(H,10,12)
InChIKey
AUEMRKAOFFIHFN-UHFFFAOYSA-N
Compound name
tert-butyl N-(2,3-dihydroxy-2-methylpropyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.13141 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.138686 147.8
[M+Na]+ 228.120628 153.0
[M-H]- 204.124134 145.3
[M+NH4]+ 223.165233 165.4
[M+K]+ 244.094568 152.9
[M+H-H2O]+ 188.128670 143.7
[M+HCOO]- 250.129611 165.7
[M+CH3COO]- 264.145261 182.7
[M+Na-2H]- 226.106076 153.1
[M]+ 205.13086142 148.7
[M]- 205.13195858 148.7
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.