CID 3053032

As-triazine, 3-methoxy-5-(1-naphthyl)-

Structural Information

Molecular Formula
C14H11N3O
SMILES
COC1=NC(=CN=N1)C2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C14H11N3O/c1-18-14-16-13(9-15-17-14)12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3
InChIKey
JADURWQFGBKBFI-UHFFFAOYSA-N
Compound name
3-methoxy-5-naphthalen-1-yl-1,2,4-triazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

237.09021 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.09749 152.8
[M+Na]+ 260.07943 170.4
[M+NH4]+ 255.12403 161.6
[M+K]+ 276.05337 161.6
[M-H]- 236.08293 157.2
[M+Na-2H]- 258.06488 163.7
[M]+ 237.08966 156.8
[M]- 237.09076 156.8
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

patents stripe