CID 216363

68946-07-6

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[1,2-c]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]+ 374.22270 193.9
[M+Na]+ 396.20464 201.9
[M-H]- 372.20814 200.5
[M+NH4]+ 391.24924 208.7
[M+K]+ 412.17858 194.1
[M+H-H2O]+ 356.21268 183.2
[M+HCOO]- 418.21362 207.6
[M+CH3COO]- 432.22927 202.7
[M+Na-2H]- 394.19009 192.0
[M]+ 373.21487 191.9
[M]- 373.21597 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.