CID 69083

2-nitro-1-naphthol

Structural Information

Molecular Formula
C10H7NO3
SMILES
C1=CC=C2C(=C1)C=CC(=C2O)[N+](=O)[O-]
InChI
InChI=1S/C10H7NO3/c12-10-8-4-2-1-3-7(8)5-6-9(10)11(13)14/h1-6,12H
InChIKey
MUCCHGOWMZTLHK-UHFFFAOYSA-N
Compound name
2-nitronaphthalen-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

689
Patents

189.04259 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.04987 134.5
[M+Na]+ 212.03181 149.6
[M+NH4]+ 207.07641 143.8
[M+K]+ 228.00575 145.4
[M-H]- 188.03531 138.7
[M+Na-2H]- 210.01726 142.0
[M]+ 189.04204 137.8
[M]- 189.04314 137.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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