CID 133298

Sari 59-801

Structural Information

Molecular Formula
C18H23N3O2
SMILES
CCC1=NOC(=C1C2=C(C3=CC=CC=C3N2)C(CN(C)C)O)C
InChI
InChI=1S/C18H23N3O2/c1-5-13-16(11(2)23-20-13)18-17(15(22)10-21(3)4)12-8-6-7-9-14(12)19-18/h6-9,15,19,22H,5,10H2,1-4H3
InChIKey
GMGOZCSXMVXXRS-UHFFFAOYSA-N
Compound name
2-(dimethylamino)-1-[2-(3-ethyl-5-methyl-1,2-oxazol-4-yl)-1H-indol-3-yl]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

14
Patents

313.17902 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 314.18630 175.1
[M+Na]+ 336.16824 187.0
[M+NH4]+ 331.21284 181.8
[M+K]+ 352.14218 185.5
[M-H]- 312.17174 178.9
[M+Na-2H]- 334.15369 179.5
[M]+ 313.17847 177.8
[M]- 313.17957 177.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe