CID 5325957

110117-71-0

Structural Information

Molecular Formula
C11H20N2O2
SMILES
CCOC1=N[C@@H](C(=NC1)OCC)C(C)C
InChI
InChI=1S/C11H20N2O2/c1-5-14-9-7-12-11(15-6-2)10(13-9)8(3)4/h8,10H,5-7H2,1-4H3/t10-/m1/s1
InChIKey
HRAZLOIRFUQOPL-SNVBAGLBSA-N
Compound name
(2R)-3,6-diethoxy-2-propan-2-yl-2,5-dihydropyrazine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

126
Patents

212.15248 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.159756 150.2
[M+Na]+ 235.141698 157.6
[M-H]- 211.145204 151.0
[M+NH4]+ 230.186303 166.9
[M+K]+ 251.115638 156.7
[M+H-H2O]+ 195.149740 142.7
[M+HCOO]- 257.150681 169.6
[M+CH3COO]- 271.166331 188.9
[M+Na-2H]- 233.127146 153.8
[M]+ 212.15193142 153.4
[M]- 212.15302858 153.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe