CID 19799269

128486-89-5

Structural Information

Molecular Formula
C17H18N4O2
SMILES
CC1=C(N=CN1)CN2CCC3=C(C2=O)C4=C(N3C)C(=CC=C4)O
InChI
InChI=1S/C17H18N4O2/c1-10-12(19-9-18-10)8-21-7-6-13-15(17(21)23)11-4-3-5-14(22)16(11)20(13)2/h3-5,9,22H,6-8H2,1-2H3,(H,18,19)
InChIKey
UUQDYYPVWUOAOE-UHFFFAOYSA-N
Compound name
6-hydroxy-5-methyl-2-[(5-methyl-1H-imidazol-4-yl)methyl]-3,4-dihydropyrido[4,3-b]indol-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

310.14297 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.15025 175.2
[M+Na]+ 333.13219 186.5
[M-H]- 309.13569 177.6
[M+NH4]+ 328.17679 189.5
[M+K]+ 349.10613 179.5
[M+H-H2O]+ 293.14023 166.9
[M+HCOO]- 355.14117 190.4
[M+CH3COO]- 369.15682 185.6
[M+Na-2H]- 331.11764 175.1
[M]+ 310.14242 176.2
[M]- 310.14352 176.2
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.