CID 14412241

(s)-2,3-dihydro-5-hydroxy-2-methyl-1,4-naphthoquinone

Structural Information

Molecular Formula
C11H10O3
SMILES
CC1CC(=O)C2=C(C1=O)C=CC=C2O
InChI
InChI=1S/C11H10O3/c1-6-5-9(13)10-7(11(6)14)3-2-4-8(10)12/h2-4,6,12H,5H2,1H3
InChIKey
ALPCEXCHMFUSAN-UHFFFAOYSA-N
Compound name
5-hydroxy-2-methyl-2,3-dihydronaphthalene-1,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1973
Patents

190.06299 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.07027 137.5
[M+Na]+ 213.05221 151.0
[M+NH4]+ 208.09681 146.1
[M+K]+ 229.02615 144.8
[M-H]- 189.05571 139.5
[M+Na-2H]- 211.03766 142.6
[M]+ 190.06244 139.9
[M]- 190.06354 139.9
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