CID 245445

2-(2-methoxyethoxy)-1-phenylethan-1-ol

Structural Information

Molecular Formula
C11H16O3
SMILES
COCCOCC(C1=CC=CC=C1)O
InChI
InChI=1S/C11H16O3/c1-13-7-8-14-9-11(12)10-5-3-2-4-6-10/h2-6,11-12H,7-9H2,1H3
InChIKey
QKYKWQPEQADNDU-UHFFFAOYSA-N
Compound name
2-(2-methoxyethoxy)-1-phenylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

196.10994 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.11722 143.8
[M+Na]+ 219.09916 149.5
[M-H]- 195.10266 145.6
[M+NH4]+ 214.14376 162.3
[M+K]+ 235.07310 148.3
[M+H-H2O]+ 179.10720 137.6
[M+HCOO]- 241.10814 165.9
[M+CH3COO]- 255.12379 181.6
[M+Na-2H]- 217.08461 149.1
[M]+ 196.10939 146.2
[M]- 196.11049 146.2
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