CID 583432

1-methylpyrrolo[1,2-a]pyrazine

Structural Information

Molecular Formula
C8H8N2
SMILES
CC1=NC=CN2C1=CC=C2
InChI
InChI=1S/C8H8N2/c1-7-8-3-2-5-10(8)6-4-9-7/h2-6H,1H3
InChIKey
OCFOYCLGYLFXCC-UHFFFAOYSA-N
Compound name
1-methylpyrrolo[1,2-a]pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

38
Patents

132.06874 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 133.07602 123.2
[M+Na]+ 155.05796 138.3
[M+NH4]+ 150.10256 133.1
[M+K]+ 171.03190 132.7
[M-H]- 131.06146 125.5
[M+Na-2H]- 153.04341 131.7
[M]+ 132.06819 126.1
[M]- 132.06929 126.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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Patent stripe

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