CID 26113

13561-08-5

Structural Information

Molecular Formula
C15H18O4
SMILES
C1C(O1)CC2=C(C(=CC=C2)CC3CO3)OCC4CO4
InChI
InChI=1S/C15H18O4/c1-2-10(4-12-6-16-12)15(19-9-14-8-18-14)11(3-1)5-13-7-17-13/h1-3,12-14H,4-9H2
InChIKey
PPEASEWKOGNDKZ-UHFFFAOYSA-N
Compound name
2-[[2,6-bis(oxiran-2-ylmethyl)phenoxy]methyl]oxirane
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

971
Patents

262.1205 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.12778 114.2
[M+Na]+ 285.10972 126.2
[M+NH4]+ 280.15432 121.5
[M+K]+ 301.08366 128.1
[M-H]- 261.11322 133.6
[M+Na-2H]- 283.09517 127.5
[M]+ 262.11995 123.7
[M]- 262.12105 123.7
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