CID 61598767

Methyl 3-{[(tert-butoxy)carbonyl](methyl)amino}-2-methylpropanoate

Structural Information

Molecular Formula
C11H21NO4
SMILES
CC(CN(C)C(=O)OC(C)(C)C)C(=O)OC
InChI
InChI=1S/C11H21NO4/c1-8(9(13)15-6)7-12(5)10(14)16-11(2,3)4/h8H,7H2,1-6H3
InChIKey
UTZHJRIZVJUPBJ-UHFFFAOYSA-N
Compound name
methyl 2-methyl-3-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.14706 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.154336 153.6
[M+Na]+ 254.136278 158.8
[M-H]- 230.139784 155.3
[M+NH4]+ 249.180883 172.3
[M+K]+ 270.110218 161.3
[M+H-H2O]+ 214.144320 148.5
[M+HCOO]- 276.145261 174.4
[M+CH3COO]- 290.160911 197.0
[M+Na-2H]- 252.121726 155.1
[M]+ 231.14651142 159.1
[M]- 231.14760858 159.1
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

No patent data available for this compound.