CID 336138

1210-07-7

Structural Information

Molecular Formula
C14H11NO
SMILES
CC1=CC(=O)NC2=C1C=CC3=CC=CC=C32
InChI
InChI=1S/C14H11NO/c1-9-8-13(16)15-14-11(9)7-6-10-4-2-3-5-12(10)14/h2-8H,1H3,(H,15,16)
InChIKey
ZMXBCQZLZQUSEA-UHFFFAOYSA-N
Compound name
4-methyl-1H-benzo[h]quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

209.08406 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.091336 142.3
[M+Na]+ 232.073278 154.1
[M-H]- 208.076784 146.1
[M+NH4]+ 227.117883 161.8
[M+K]+ 248.047218 148.0
[M+H-H2O]+ 192.081320 135.4
[M+HCOO]- 254.082261 163.8
[M+CH3COO]- 268.097911 156.0
[M+Na-2H]- 230.058726 152.6
[M]+ 209.08351142 143.4
[M]- 209.08460858 143.4
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

patents stripe