CID 18698256

Tert-butyl 2-amino-3-methoxypropanoate hydrochloride

Structural Information

Molecular Formula
C8H17NO3
SMILES
CC(C)(C)OC(=O)C(COC)N
InChI
InChI=1S/C8H17NO3/c1-8(2,3)12-7(10)6(9)5-11-4/h6H,5,9H2,1-4H3
InChIKey
JJFUNEGRIGWPFT-UHFFFAOYSA-N
Compound name
tert-butyl 2-amino-3-methoxypropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

175.12085 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.12813 140.4
[M+Na]+ 198.11007 146.4
[M-H]- 174.11357 140.3
[M+NH4]+ 193.15467 160.4
[M+K]+ 214.08401 147.4
[M+H-H2O]+ 158.11811 135.7
[M+HCOO]- 220.11905 161.4
[M+CH3COO]- 234.13470 183.1
[M+Na-2H]- 196.09552 143.9
[M]+ 175.12030 142.4
[M]- 175.12140 142.4
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