PubChemLite - Azd-0364 (C24H24F2N8O2)

Structural Information

Molecular Formula

SMILES

CC1=CN=C(N=C1C2=CN3C[C@@H](N(C(=O)C3=N2)CC4=CC(=C(C=C4)F)F)COC)NC5=CC=NN5C

InChI

InChI=1S/C24H24F2N8O2/c1-14-9-27-24(30-20-6-7-28-32(20)2)31-21(14)19-12-33-11-16(13-36-3)34(23(35)22(33)29-19)10-15-4-5-17(25)18(26)8-15/h4-9,12,16H,10-11,13H2,1-3H3,(H,27,30,31)/t16-/m1/s1

InChIKey

HVIGNZUDBVLTLU-MRXNPFEDSA-N

Compound name

(6R)-7-[(3,4-difluorophenyl)methyl]-6-(methoxymethyl)-2-[5-methyl-2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-5,6-dihydroimidazo[1,2-a]pyrazin-8-one

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]+	495.20632	221.3
[M+Na]+	517.18826	232.6
[M-H]-	493.19176	226.0
[M+NH4]+	512.23286	223.4
[M+K]+	533.16220	223.0
[M+H-H2O]+	477.19630	206.3
[M+HCOO]-	539.19724	233.9
[M+CH3COO]-	553.21289	227.7
[M+Na-2H]-	515.17371	216.8
[M]+	494.19849	224.0
[M]-	494.19959	224.0

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

495.20632

221.3

[M+Na]+

517.18826

232.6

[M-H]-

493.19176

226.0

[M+NH4]+

512.23286

223.4

[M+K]+

533.16220

223.0

[M+H-H2O]+

477.19630

206.3

[M+HCOO]-

539.19724

233.9

[M+CH3COO]-

553.21289

227.7

[M+Na-2H]-

515.17371

216.8

[M]+

494.19849

224.0

[M]-

494.19959

224.0

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

Azd-0364

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

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