CID 105456365

1785299-24-2

Structural Information

Molecular Formula
C9H20N2O3
SMILES
CC(C)(C)OC(=O)NCC(C)(CN)O
InChI
InChI=1S/C9H20N2O3/c1-8(2,3)14-7(12)11-6-9(4,13)5-10/h13H,5-6,10H2,1-4H3,(H,11,12)
InChIKey
VPRUETRGYFOOIY-UHFFFAOYSA-N
Compound name
tert-butyl N-(3-amino-2-hydroxy-2-methylpropyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

204.1474 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.154676 148.6
[M+Na]+ 227.136618 153.4
[M-H]- 203.140124 147.0
[M+NH4]+ 222.181223 166.4
[M+K]+ 243.110558 153.3
[M+H-H2O]+ 187.144660 143.9
[M+HCOO]- 249.145601 168.1
[M+CH3COO]- 263.161251 187.6
[M+Na-2H]- 225.122066 153.4
[M]+ 204.14685142 148.1
[M]- 204.14794858 148.1
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