CID 221529

Di-m-tolyl carbonate

Structural Information

Molecular Formula
C15H14O3
SMILES
CC1=CC(=CC=C1)OC(=O)OC2=CC=CC(=C2)C
InChI
InChI=1S/C15H14O3/c1-11-5-3-7-13(9-11)17-15(16)18-14-8-4-6-12(2)10-14/h3-10H,1-2H3
InChIKey
PDYNXWPJDVOHDW-UHFFFAOYSA-N
Compound name
bis(3-methylphenyl) carbonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

851
Patents

242.0943 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.10158 153.7
[M+Na]+ 265.08352 168.7
[M+NH4]+ 260.12812 162.2
[M+K]+ 281.05746 161.3
[M-H]- 241.08702 158.1
[M+Na-2H]- 263.06897 163.1
[M]+ 242.09375 157.2
[M]- 242.09485 157.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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