CID 380609

Nsc666284

Structural Information

Molecular Formula
C14H16N2O2
SMILES
CC1=C2CCNC2=C3C=C(C=C(C3=N1)OC)OC
InChI
InChI=1S/C14H16N2O2/c1-8-10-4-5-15-13(10)11-6-9(17-2)7-12(18-3)14(11)16-8/h6-7,15H,4-5H2,1-3H3
InChIKey
ISCFTPATSJORAR-UHFFFAOYSA-N
Compound name
6,8-dimethoxy-4-methyl-2,3-dihydro-1H-pyrrolo[3,2-c]quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.12119 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.12847 155.6
[M+Na]+ 267.11041 165.7
[M-H]- 243.11391 157.6
[M+NH4]+ 262.15501 174.3
[M+K]+ 283.08435 161.3
[M+H-H2O]+ 227.11845 148.4
[M+HCOO]- 289.11939 173.7
[M+CH3COO]- 303.13504 167.8
[M+Na-2H]- 265.09586 160.2
[M]+ 244.12064 157.8
[M]- 244.12174 157.8
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.