CID 2733206

26690-80-2

Structural Information

Molecular Formula
C7H15NO3
SMILES
CC(C)(C)OC(=O)NCCO
InChI
InChI=1S/C7H15NO3/c1-7(2,3)11-6(10)8-4-5-9/h9H,4-5H2,1-3H3,(H,8,10)
InChIKey
GPTXCAZYUMDUMN-UHFFFAOYSA-N
Compound name
tert-butyl N-(2-hydroxyethyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6799
Patents

161.1052 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.11248 136.3
[M+Na]+ 184.09442 142.5
[M-H]- 160.09792 135.4
[M+NH4]+ 179.13902 156.5
[M+K]+ 200.06836 142.8
[M+H-H2O]+ 144.10246 131.9
[M+HCOO]- 206.10340 157.7
[M+CH3COO]- 220.11905 176.5
[M+Na-2H]- 182.07987 142.0
[M]+ 161.10465 137.5
[M]- 161.10575 137.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe