CID 162343814

2708288-03-1

Structural Information

Molecular Formula
C15H20N2O4
SMILES
CC(C)(C)OC(=O)N1CCNC2=C1C=C(C=C2)C(=O)OC
InChI
InChI=1S/C15H20N2O4/c1-15(2,3)21-14(19)17-8-7-16-11-6-5-10(9-12(11)17)13(18)20-4/h5-6,9,16H,7-8H2,1-4H3
InChIKey
QFMVTNCYSRZLCU-UHFFFAOYSA-N
Compound name
1-O-tert-butyl 7-O-methyl 3,4-dihydro-2H-quinoxaline-1,7-dicarboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.1423 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.149576 168.8
[M+Na]+ 315.131518 174.8
[M-H]- 291.135024 168.8
[M+NH4]+ 310.176123 182.1
[M+K]+ 331.105458 172.7
[M+H-H2O]+ 275.139560 161.5
[M+HCOO]- 337.140501 181.8
[M+CH3COO]- 351.156151 198.8
[M+Na-2H]- 313.116966 172.1
[M]+ 292.14175142 169.1
[M]- 292.14284858 169.1
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.