CID 15048339

(3-chloropyrazin-2-yl)(phenyl)methanone

Structural Information

Molecular Formula
C11H7ClN2O
SMILES
C1=CC=C(C=C1)C(=O)C2=NC=CN=C2Cl
InChI
InChI=1S/C11H7ClN2O/c12-11-9(13-6-7-14-11)10(15)8-4-2-1-3-5-8/h1-7H
InChIKey
HPNXDUXDGMPNOJ-UHFFFAOYSA-N
Compound name
(3-chloropyrazin-2-yl)-phenylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

218.02469 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.03197 143.8
[M+Na]+ 241.01391 160.4
[M+NH4]+ 236.05851 152.6
[M+K]+ 256.98785 152.4
[M-H]- 217.01741 147.5
[M+Na-2H]- 238.99936 154.5
[M]+ 218.02414 147.6
[M]- 218.02524 147.6
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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