CID 5181087

2-naphthalenol, 1-[(5-methyl-1h-pyrazol-3-yl)azo]-

Structural Information

Molecular Formula
C14H12N4O
SMILES
CC1=CC(=NN1)N=NC2=C(C=CC3=CC=CC=C32)O
InChI
InChI=1S/C14H12N4O/c1-9-8-13(16-15-9)17-18-14-11-5-3-2-4-10(11)6-7-12(14)19/h2-8,19H,1H3,(H,15,16)
InChIKey
KYYPQOBBHVDITM-UHFFFAOYSA-N
Compound name
1-[(5-methyl-1H-pyrazol-3-yl)diazenyl]naphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

252.1011 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.10838 155.4
[M+Na]+ 275.09032 169.9
[M+NH4]+ 270.13492 163.5
[M+K]+ 291.06426 164.1
[M-H]- 251.09382 160.1
[M+Na-2H]- 273.07577 164.7
[M]+ 252.10055 158.7
[M]- 252.10165 158.7
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.