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

209
Patents

189.13649 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.14377 145.1
[M+Na]+ 212.12571 150.9
[M-H]- 188.12921 144.7
[M+NH4]+ 207.17031 164.5
[M+K]+ 228.09965 151.1
[M+H-H2O]+ 172.13375 140.1
[M+HCOO]- 234.13469 166.8
[M+CH3COO]- 248.15034 185.2
[M+Na-2H]- 210.11116 149.3
[M]+ 189.13594 148.1
[M]- 189.13704 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