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]+ 243.101576 150.6
[M+Na]+ 265.083518 159.6
[M-H]- 241.087024 161.6
[M+NH4]+ 260.128123 161.8
[M+K]+ 281.057458 158.1
[M+H-H2O]+ 225.091560 142.4
[M+HCOO]- 287.092501 174.9
[M+CH3COO]- 301.108151 193.7
[M+Na-2H]- 263.068966 158.7
[M]+ 242.09375142 156.2
[M]- 242.09484858 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