CID 64982554

2-chloro-3-cyclopropylpyrazine

Structural Information

Molecular Formula
C7H7ClN2
SMILES
C1CC1C2=NC=CN=C2Cl
InChI
InChI=1S/C7H7ClN2/c8-7-6(5-1-2-5)9-3-4-10-7/h3-5H,1-2H2
InChIKey
IKYQHZYJFMQTST-UHFFFAOYSA-N
Compound name
2-chloro-3-cyclopropylpyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

154.02977 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.03705 132.1
[M+Na]+ 177.01899 143.5
[M-H]- 153.02249 136.7
[M+NH4]+ 172.06359 146.5
[M+K]+ 192.99293 139.2
[M+H-H2O]+ 137.02703 124.5
[M+HCOO]- 199.02797 150.7
[M+CH3COO]- 213.04362 145.5
[M+Na-2H]- 175.00444 140.0
[M]+ 154.02922 135.0
[M]- 154.03032 135.0
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

patents stripe