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

10
Patents

202.09938 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.10666 142.7
[M+Na]+ 225.08860 151.3
[M-H]- 201.09210 146.2
[M+NH4]+ 220.13320 162.7
[M+K]+ 241.06254 147.8
[M+H-H2O]+ 185.09664 136.8
[M+HCOO]- 247.09758 164.9
[M+CH3COO]- 261.11323 184.5
[M+Na-2H]- 223.07405 150.3
[M]+ 202.09883 144.7
[M]- 202.09993 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