CID 163335694

(2s,3r)-3-(tert-butoxy)-2-(dimethylamino)butanoic acid

Structural Information

Molecular Formula
C10H21NO3
SMILES
C[C@H]([C@@H](C(=O)O)N(C)C)OC(C)(C)C
InChI
InChI=1S/C10H21NO3/c1-7(14-10(2,3)4)8(9(12)13)11(5)6/h7-8H,1-6H3,(H,12,13)/t7-,8+/m1/s1
InChIKey
DGXPEQAYAJNYSK-SFYZADRCSA-N
Compound name
(2S,3R)-2-(dimethylamino)-3-[(2-methylpropan-2-yl)oxy]butanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

203.15215 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.159426 148.2
[M+Na]+ 226.141368 152.8
[M-H]- 202.144874 148.4
[M+NH4]+ 221.185973 167.0
[M+K]+ 242.115308 154.7
[M+H-H2O]+ 186.149410 143.4
[M+HCOO]- 248.150351 167.2
[M+CH3COO]- 262.166001 192.3
[M+Na-2H]- 224.126816 149.3
[M]+ 203.15160142 150.7
[M]- 203.15269858 150.7
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

No patent data available for this compound.