CID 5371945

2-methyl-6-(1-propenyl)pyrazine

Structural Information

Molecular Formula
C8H10N2
SMILES
C/C=C/C1=NC(=CN=C1)C
InChI
InChI=1S/C8H10N2/c1-3-4-8-6-9-5-7(2)10-8/h3-6H,1-2H3/b4-3+
InChIKey
NOBVHXZAVPKZQU-ONEGZZNKSA-N
Compound name
2-methyl-6-[(E)-prop-1-enyl]pyrazine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

13
Patents

134.0844 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 135.09168 126.8
[M+Na]+ 157.07362 136.1
[M-H]- 133.07712 127.9
[M+NH4]+ 152.11822 146.4
[M+K]+ 173.04756 133.7
[M+H-H2O]+ 117.08166 120.0
[M+HCOO]- 179.08260 149.3
[M+CH3COO]- 193.09825 173.3
[M+Na-2H]- 155.05907 135.1
[M]+ 134.08385 127.0
[M]- 134.08495 127.0
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