CID 896304

(2-ethoxynaphthalen-1-yl)methanol

Structural Information

Molecular Formula
C13H14O2
SMILES
CCOC1=C(C2=CC=CC=C2C=C1)CO
InChI
InChI=1S/C13H14O2/c1-2-15-13-8-7-10-5-3-4-6-11(10)12(13)9-14/h3-8,14H,2,9H2,1H3
InChIKey
USEQXNGDJGPZOP-UHFFFAOYSA-N
Compound name
(2-ethoxynaphthalen-1-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

202.09938 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.106656 142.7
[M+Na]+ 225.088598 151.3
[M-H]- 201.092104 146.2
[M+NH4]+ 220.133203 162.7
[M+K]+ 241.062538 147.8
[M+H-H2O]+ 185.096640 136.8
[M+HCOO]- 247.097581 164.9
[M+CH3COO]- 261.113231 184.5
[M+Na-2H]- 223.074046 150.3
[M]+ 202.09883142 144.7
[M]- 202.09992858 144.7
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

patents stripe