CID 9588817

Brn 5814772

Structural Information

Molecular Formula
C10H16N2O4
SMILES
CCOC(=O)ON1CCC=C(C1)/C=N/OC
InChI
InChI=1S/C10H16N2O4/c1-3-15-10(13)16-12-6-4-5-9(8-12)7-11-14-2/h5,7H,3-4,6,8H2,1-2H3/b11-7+
InChIKey
VXVJHSREBVRLTO-YRNVUSSQSA-N
Compound name
ethyl [5-[(E)-methoxyiminomethyl]-3,6-dihydro-2H-pyridin-1-yl] carbonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.11101 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.11829 149.4
[M+Na]+ 251.10023 155.0
[M-H]- 227.10373 152.3
[M+NH4]+ 246.14483 166.4
[M+K]+ 267.07417 155.5
[M+H-H2O]+ 211.10827 141.6
[M+HCOO]- 273.10921 172.3
[M+CH3COO]- 287.12486 191.6
[M+Na-2H]- 249.08568 154.1
[M]+ 228.11046 152.3
[M]- 228.11156 152.3
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.