CID 736065

78342-42-4

Structural Information

Molecular Formula

C₉H₁₆N₂O₂

SMILES

CC(C)[C@H]1C(=NCC(=N1)OC)OC

InChI

InChI=1S/C9H16N2O2/c1-6(2)8-9(13-4)10-5-7(11-8)12-3/h6,8H,5H2,1-4H3/t8-/m0/s1

InChIKey

FCFWEOGTZZPCTO-QMMMGPOBSA-N

Compound name

(2S)-3,6-dimethoxy-2-propan-2-yl-2,5-dihydropyrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 866
Patents: 184.12119 Da
Monoisotopic Mass: 1.4
XlogP (predicted)

Profile

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]+	185.12847	141.0
[M+Na]+	207.11041	153.2
[M+NH4]+	202.15501	148.3
[M+K]+	223.08435	148.0
[M-H]-	183.11391	141.4
[M+Na-2H]-	205.09586	146.2
[M]+	184.12064	142.7
[M]-	184.12174	142.7

Literature stripe

literature stripe

Patent stripe

patents stripe