CID 848468

55635-70-6

Structural Information

Molecular Formula
C18H23N5O2
SMILES
CC1=C(N=C2C(=N1)N=C(N2C)NCCC3=CC(=C(C=C3)OC)OC)C
InChI
InChI=1S/C18H23N5O2/c1-11-12(2)21-17-16(20-11)22-18(23(17)3)19-9-8-13-6-7-14(24-4)15(10-13)25-5/h6-7,10H,8-9H2,1-5H3,(H,19,20,22)
InChIKey
HVYNUXBKWKUETH-UHFFFAOYSA-N
Compound name
N-[2-(3,4-dimethoxyphenyl)ethyl]-3,5,6-trimethylimidazo[4,5-b]pyrazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

341.18518 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.192456 184.6
[M+Na]+ 364.174398 196.1
[M-H]- 340.177904 188.5
[M+NH4]+ 359.219003 196.2
[M+K]+ 380.148338 190.6
[M+H-H2O]+ 324.182440 174.1
[M+HCOO]- 386.183381 205.4
[M+CH3COO]- 400.199031 218.2
[M+Na-2H]- 362.159846 187.8
[M]+ 341.18463142 192.4
[M]- 341.18572858 192.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.