CID 84638931

1784786-58-8

Structural Information

Molecular Formula
C15H22N2O2
SMILES
CCC1=C2C(=CC=C1)NCCN2C(=O)OC(C)(C)C
InChI
InChI=1S/C15H22N2O2/c1-5-11-7-6-8-12-13(11)17(10-9-16-12)14(18)19-15(2,3)4/h6-8,16H,5,9-10H2,1-4H3
InChIKey
XHJJXKWRGIGQCZ-UHFFFAOYSA-N
Compound name
tert-butyl 8-ethyl-3,4-dihydro-2H-quinoxaline-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.16812 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.17540 165.1
[M+Na]+ 285.15734 171.3
[M-H]- 261.16084 164.9
[M+NH4]+ 280.20194 179.8
[M+K]+ 301.13128 167.9
[M+H-H2O]+ 245.16538 157.8
[M+HCOO]- 307.16632 178.5
[M+CH3COO]- 321.18197 195.1
[M+Na-2H]- 283.14279 169.1
[M]+ 262.16757 163.8
[M]- 262.16867 163.8
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.