CID 3067339

M.g. 18823

Structural Information

Molecular Formula
C20H23N3O2
SMILES
CC(C1=CC=C(C=C1)N2C=C3C=CC=CC3=N2)C(=O)OCCN(C)C
InChI
InChI=1S/C20H23N3O2/c1-15(20(24)25-13-12-22(2)3)16-8-10-18(11-9-16)23-14-17-6-4-5-7-19(17)21-23/h4-11,14-15H,12-13H2,1-3H3
InChIKey
LCXPYUHHRDUDLA-UHFFFAOYSA-N
Compound name
2-(dimethylamino)ethyl 2-(4-indazol-2-ylphenyl)propanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.17902 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.18630 180.3
[M+Na]+ 360.16824 193.4
[M+NH4]+ 355.21284 187.4
[M+K]+ 376.14218 188.4
[M-H]- 336.17174 184.0
[M+Na-2H]- 358.15369 187.8
[M]+ 337.17847 183.2
[M]- 337.17957 183.2
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.