CID 21865010

956795-05-4

Structural Information

Molecular Formula
C13H15N3
SMILES
C1CN2C(=NC=C2CC3=CC=CC=C3)CN1
InChI
InChI=1S/C13H15N3/c1-2-4-11(5-3-1)8-12-9-15-13-10-14-6-7-16(12)13/h1-5,9,14H,6-8,10H2
InChIKey
QJBUFQIGRQDVTP-UHFFFAOYSA-N
Compound name
3-benzyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

213.1266 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.133876 148.3
[M+Na]+ 236.115818 155.3
[M-H]- 212.119324 149.9
[M+NH4]+ 231.160423 164.6
[M+K]+ 252.089758 150.0
[M+H-H2O]+ 196.123860 139.0
[M+HCOO]- 258.124801 165.3
[M+CH3COO]- 272.140451 159.2
[M+Na-2H]- 234.101266 153.8
[M]+ 213.12605142 143.8
[M]- 213.12714858 143.8
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