CID 129847044

1218815-84-9

Structural Information

Molecular Formula
C8H15NO4
SMILES
CC(C)(C)OC(=O)C(=O)N(C)OC
InChI
InChI=1S/C8H15NO4/c1-8(2,3)13-7(11)6(10)9(4)12-5/h1-5H3
InChIKey
DCSBEGCJZBZJIG-UHFFFAOYSA-N
Compound name
tert-butyl 2-[methoxy(methyl)amino]-2-oxoacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

189.10011 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.10739 140.0
[M+Na]+ 212.08933 146.6
[M-H]- 188.09283 142.1
[M+NH4]+ 207.13393 160.4
[M+K]+ 228.06327 149.3
[M+H-H2O]+ 172.09737 135.2
[M+HCOO]- 234.09831 162.7
[M+CH3COO]- 248.11396 187.1
[M+Na-2H]- 210.07478 144.1
[M]+ 189.09956 144.9
[M]- 189.10066 144.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe