PubChemLite - Bis(2-(2-methylprop-2-enoyloxy)ethyl) 4-(4-(2-methylprop-2-enoyloxy)phenyl)benzene-1,3-dicarboxylate (C30H30O10)

Structural Information

Molecular Formula

SMILES

CC(=C)C(=O)OCCOC(=O)C1=CC(=C(C=C1)C2=CC=C(C=C2)OC(=O)C(=C)C)C(=O)OCCOC(=O)C(=C)C

InChI

InChI=1S/C30H30O10/c1-18(2)26(31)36-13-15-38-29(34)22-9-12-24(21-7-10-23(11-8-21)40-28(33)20(5)6)25(17-22)30(35)39-16-14-37-27(32)19(3)4/h7-12,17H,1,3,5,13-16H2,2,4,6H3

InChIKey

KQOUWHTWIXIAKB-UHFFFAOYSA-N

Compound name

bis[2-(2-methylprop-2-enoyloxy)ethyl] 4-[4-(2-methylprop-2-enoyloxy)phenyl]benzene-1,3-dicarboxylate

Related CIDs

2D Structure

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	551.19118	219.1
[M+Na]+	573.17312	233.1
[M+NH4]+	568.21772	237.2
[M+K]+	589.14706	232.2
[M-H]-	549.17662	233.1
[M+Na-2H]-	571.15857	219.1
[M]+	550.18335	233.1
[M]-	550.18445	233.1

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

551.19118

219.1

[M+Na]+

573.17312

233.1

[M+NH4]+

568.21772

237.2

[M+K]+

589.14706

232.2

[M-H]-

549.17662

233.1

[M+Na-2H]-

571.15857

219.1

[M]+

550.18335

233.1

[M]-

550.18445

233.1

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.

Bis(2-(2-methylprop-2-enoyloxy)ethyl) 4-(4-(2-methylprop-2-enoyloxy)phenyl)benzene-1,3-dicarboxylate

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe