CID 59256380

1260092-46-3

Structural Information

Molecular Formula
C9H19NO3
SMILES
CC(C)(C)OC(=O)CCOCCN
InChI
InChI=1S/C9H19NO3/c1-9(2,3)13-8(11)4-6-12-7-5-10/h4-7,10H2,1-3H3
InChIKey
NSCCYXHEZRMPPH-UHFFFAOYSA-N
Compound name
tert-butyl 3-(2-aminoethoxy)propanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

205
Patents

189.13649 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.143766 145.1
[M+Na]+ 212.125708 150.9
[M-H]- 188.129214 144.7
[M+NH4]+ 207.170313 164.5
[M+K]+ 228.099648 151.1
[M+H-H2O]+ 172.133750 140.1
[M+HCOO]- 234.134691 166.8
[M+CH3COO]- 248.150341 185.2
[M+Na-2H]- 210.111156 149.3
[M]+ 189.13594142 148.1
[M]- 189.13703858 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