CID 15590006

2-[(4-phenoxyphenoxy)methyl]oxirane

Structural Information

Molecular Formula
C15H14O3
SMILES
C1C(O1)COC2=CC=C(C=C2)OC3=CC=CC=C3
InChI
InChI=1S/C15H14O3/c1-2-4-13(5-3-1)18-14-8-6-12(7-9-14)16-10-15-11-17-15/h1-9,15H,10-11H2
InChIKey
JLMPGCFZWRLQMV-UHFFFAOYSA-N
Compound name
2-[(4-phenoxyphenoxy)methyl]oxirane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

98
Patents

242.0943 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.10158 150.6
[M+Na]+ 265.08352 159.6
[M-H]- 241.08702 161.6
[M+NH4]+ 260.12812 161.8
[M+K]+ 281.05746 158.1
[M+H-H2O]+ 225.09156 142.4
[M+HCOO]- 287.09250 174.9
[M+CH3COO]- 301.10815 193.7
[M+Na-2H]- 263.06897 158.7
[M]+ 242.09375 156.2
[M]- 242.09485 156.2
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