CID 21119044

Itjdlagysxnwnw-uhfffaoysa-n

Structural Information

Molecular Formula
C11H14O5
SMILES
CCOC(=O)OCC1=CC(=C(C=C1)O)OC
InChI
InChI=1S/C11H14O5/c1-3-15-11(13)16-7-8-4-5-9(12)10(6-8)14-2/h4-6,12H,3,7H2,1-2H3
InChIKey
ITJDLAGYSXNWNW-UHFFFAOYSA-N
Compound name
ethyl (4-hydroxy-3-methoxyphenyl)methyl carbonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.08412 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.091396 147.0
[M+Na]+ 249.073338 154.9
[M-H]- 225.076844 149.7
[M+NH4]+ 244.117943 164.9
[M+K]+ 265.047278 154.3
[M+H-H2O]+ 209.081380 141.0
[M+HCOO]- 271.082321 169.8
[M+CH3COO]- 285.097971 186.0
[M+Na-2H]- 247.058786 151.2
[M]+ 226.08357142 152.3
[M]- 226.08466858 152.3
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

No patent data available for this compound.