CID 99348

909-41-1

Structural Information

Molecular Formula
C18H19NO8
SMILES
CC1=CN2C(C(=C(C(=C2C=C1)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC
InChI
InChI=1S/C18H19NO8/c1-9-6-7-10-11(15(20)24-2)12(16(21)25-3)13(17(22)26-4)14(18(23)27-5)19(10)8-9/h6-8,14H,1-5H3
InChIKey
MLOKKRWFMGCUSG-UHFFFAOYSA-N
Compound name
tetramethyl 7-methyl-4H-quinolizine-1,2,3,4-tetracarboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

377.11105 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 378.11833 179.2
[M+Na]+ 400.10027 186.7
[M-H]- 376.10377 182.7
[M+NH4]+ 395.14487 191.0
[M+K]+ 416.07421 187.4
[M+H-H2O]+ 360.10831 171.7
[M+HCOO]- 422.10925 196.1
[M+CH3COO]- 436.12490 219.9
[M+Na-2H]- 398.08572 178.1
[M]+ 377.11050 188.2
[M]- 377.11160 188.2
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.