PubChemLite - Einecs 264-570-4 (C57H86N2O8)

Structural Information

Molecular Formula

SMILES

CC1(CC(CC(N1C(=O)C=C)(C)C)OC(=O)C(CC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)(CC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)C(=O)OC4CC(N(C(C4)(C)C)C(=O)C=C)(C)C)C

InChI

InChI=1S/C57H86N2O8/c1-23-43(60)58-53(15,16)31-37(32-54(58,17)18)66-47(64)57(29-35-25-39(49(3,4)5)45(62)40(26-35)50(6,7)8,30-36-27-41(51(9,10)11)46(63)42(28-36)52(12,13)14)48(65)67-38-33-55(19,20)59(44(61)24-2)56(21,22)34-38/h23-28,37-38,62-63H,1-2,29-34H2,3-22H3

InChIKey

ZVKKVSDZZGHJID-UHFFFAOYSA-N

Compound name

bis(2,2,6,6-tetramethyl-1-prop-2-enoylpiperidin-4-yl) 2,2-bis[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]propanedioate

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]+	927.64568	254.2
[M+Na]+	949.62762	266.4
[M-H]-	925.63112	258.2
[M+NH4]+	944.67222	287.2
[M+K]+	965.60156	236.7
[M+H-H2O]+	909.63566	236.3
[M+HCOO]-	971.63660	288.3
[M+CH3COO]-	985.65225	320.8
[M+Na-2H]-	947.61307	280.4
[M]+	926.63785	276.9
[M]-	926.63895	276.9

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

927.64568

254.2

[M+Na]+

949.62762

266.4

[M-H]-

925.63112

258.2

[M+NH4]+

944.67222

287.2

[M+K]+

965.60156

236.7

[M+H-H2O]+

909.63566

236.3

[M+HCOO]-

971.63660

288.3

[M+CH3COO]-

985.65225

320.8

[M+Na-2H]-

947.61307

280.4

[M]+

926.63785

276.9

[M]-

926.63895

276.9

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

Einecs 264-570-4

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe