CID 177798065

1-chloro-3-cyclopropylpyrrolo[1,2-a]pyrazine

Structural Information

Molecular Formula
C10H9ClN2
SMILES
C1CC1C2=CN3C=CC=C3C(=N2)Cl
InChI
InChI=1S/C10H9ClN2/c11-10-9-2-1-5-13(9)6-8(12-10)7-3-4-7/h1-2,5-7H,3-4H2
InChIKey
ATMDBMVXJFZSRW-UHFFFAOYSA-N
Compound name
1-chloro-3-cyclopropylpyrrolo[1,2-a]pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.04543 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.052706 141.1
[M+Na]+ 215.034648 154.6
[M-H]- 191.038154 146.9
[M+NH4]+ 210.079253 157.0
[M+K]+ 231.008588 148.5
[M+H-H2O]+ 175.042690 133.7
[M+HCOO]- 237.043631 160.4
[M+CH3COO]- 251.059281 154.9
[M+Na-2H]- 213.020096 147.9
[M]+ 192.04488142 146.4
[M]- 192.04597858 146.4
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

No patent data available for this compound.