CID 2770913

1-(2-fluorophenyl)-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine

Structural Information

Molecular Formula
C13H13FN2
SMILES
C1CN2C=CC=C2C(N1)C3=CC=CC=C3F
InChI
InChI=1S/C13H13FN2/c14-11-5-2-1-4-10(11)13-12-6-3-8-16(12)9-7-15-13/h1-6,8,13,15H,7,9H2
InChIKey
RCGRCTXPSVQZEH-UHFFFAOYSA-N
Compound name
1-(2-fluorophenyl)-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

216.10628 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.11356 148.6
[M+Na]+ 239.09550 161.6
[M+NH4]+ 234.14010 157.5
[M+K]+ 255.06944 155.5
[M-H]- 215.09900 150.9
[M+Na-2H]- 237.08095 155.5
[M]+ 216.10573 151.0
[M]- 216.10683 151.0
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