CID 76843

2-hydroxynaphthol blue

Structural Information

Molecular Formula
C18H14N2O2
SMILES
CN(C)C1=CC2=C(C=C1)N=C3C(=CC=C4C3=CC(=O)C=C4)O2
InChI
InChI=1S/C18H14N2O2/c1-20(2)12-5-7-15-17(9-12)22-16-8-4-11-3-6-13(21)10-14(11)18(16)19-15/h3-10H,1-2H3
InChIKey
HPTZLSMMARHQSN-UHFFFAOYSA-N
Compound name
9-(dimethylamino)benzo[a]phenoxazin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

2
Patents

290.10553 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.11281 164.4
[M+Na]+ 313.09475 183.1
[M+NH4]+ 308.13935 174.5
[M+K]+ 329.06869 174.0
[M-H]- 289.09825 171.5
[M+Na-2H]- 311.08020 173.1
[M]+ 290.10498 169.5
[M]- 290.10608 169.5
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.