CID 10376046

129765-95-3

Structural Information

Molecular Formula
C10H19NO4
SMILES
CC(C)(C)OC(=O)NC(C)(C)CC(=O)O
InChI
InChI=1S/C10H19NO4/c1-9(2,3)15-8(14)11-10(4,5)6-7(12)13/h6H2,1-5H3,(H,11,14)(H,12,13)
InChIKey
LHJVMOIOTPJSLS-UHFFFAOYSA-N
Compound name
3-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

632
Patents

217.13141 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.13869 149.5
[M+Na]+ 240.12063 154.9
[M-H]- 216.12413 148.5
[M+NH4]+ 235.16523 167.3
[M+K]+ 256.09457 155.3
[M+H-H2O]+ 200.12867 145.3
[M+HCOO]- 262.12961 167.9
[M+CH3COO]- 276.14526 188.1
[M+Na-2H]- 238.10608 153.7
[M]+ 217.13086 151.5
[M]- 217.13196 151.5
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