CID 216363

1-ethyl-4-(1-methyl-4-piperidyl)-3-phenyl-1,4-dihydroindeno(1,2-c)pyrazol-4-ol

Structural Information

Molecular Formula
C24H27N3O
SMILES
CCN1C2=C(C(=N1)C3=CC=CC=C3)C(C4=CC=CC=C42)(C5CCN(CC5)C)O
InChI
InChI=1S/C24H27N3O/c1-3-27-23-19-11-7-8-12-20(19)24(28,18-13-15-26(2)16-14-18)21(23)22(25-27)17-9-5-4-6-10-17/h4-12,18,28H,3,13-16H2,1-2H3
InChIKey
FHMGZWYZFUYFRS-UHFFFAOYSA-N
Compound name
1-ethyl-4-(1-methylpiperidin-4-yl)-3-phenylindeno[2,1-d]pyrazol-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

373.21542 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.222696 193.9
[M+Na]+ 396.204638 201.9
[M-H]- 372.208144 200.5
[M+NH4]+ 391.249243 208.7
[M+K]+ 412.178578 194.1
[M+H-H2O]+ 356.212680 183.2
[M+HCOO]- 418.213621 207.6
[M+CH3COO]- 432.229271 202.7
[M+Na-2H]- 394.190086 192.0
[M]+ 373.21487142 191.9
[M]- 373.21596858 191.9
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.