CID 3076267

7-(1-methylethyl)-6-phenyl-1h-imidazo(1,2-b)pyrazole

Structural Information

Molecular Formula
C14H15N3
SMILES
CC(C)C1=C(NN2C1=NC=C2)C3=CC=CC=C3
InChI
InChI=1S/C14H15N3/c1-10(2)12-13(11-6-4-3-5-7-11)16-17-9-8-15-14(12)17/h3-10,16H,1-2H3
InChIKey
ZZLBUIQATLYXHI-UHFFFAOYSA-N
Compound name
6-phenyl-7-propan-2-yl-5H-imidazo[1,2-b]pyrazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

225.1266 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.13388 151.1
[M+Na]+ 248.11582 161.1
[M-H]- 224.11932 154.6
[M+NH4]+ 243.16042 169.4
[M+K]+ 264.08976 156.1
[M+H-H2O]+ 208.12386 142.9
[M+HCOO]- 270.12480 171.9
[M+CH3COO]- 284.14045 163.7
[M+Na-2H]- 246.10127 154.3
[M]+ 225.12605 152.0
[M]- 225.12715 152.0
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