CID 13451609

103910-33-4

Structural Information

Molecular Formula
C9H17NO3
SMILES
CCOC(=N)C(C)(C)C(=O)OCC
InChI
InChI=1S/C9H17NO3/c1-5-12-7(10)9(3,4)8(11)13-6-2/h10H,5-6H2,1-4H3
InChIKey
CVCSYNSUBQDSEV-UHFFFAOYSA-N
Compound name
ethyl 3-ethoxy-3-imino-2,2-dimethylpropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

187.12085 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.128126 143.0
[M+Na]+ 210.110068 148.8
[M-H]- 186.113574 143.2
[M+NH4]+ 205.154673 162.6
[M+K]+ 226.084008 149.3
[M+H-H2O]+ 170.118110 138.2
[M+HCOO]- 232.119051 164.5
[M+CH3COO]- 246.134701 185.8
[M+Na-2H]- 208.095516 147.0
[M]+ 187.12030142 145.6
[M]- 187.12139858 145.6
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