CID 16727823

(2z)-2-hydroxyimino-1,2-bis(1-methylindol-3-yl)ethanone

Structural Information

Molecular Formula
C20H17N3O2
SMILES
CN1C=C(C2=CC=CC=C21)/C(=N/O)/C(=O)C3=CN(C4=CC=CC=C43)C
InChI
InChI=1S/C20H17N3O2/c1-22-11-15(13-7-3-5-9-17(13)22)19(21-25)20(24)16-12-23(2)18-10-6-4-8-14(16)18/h3-12,25H,1-2H3/b21-19-
InChIKey
ZARLHOCWYXITIN-VZCXRCSSSA-N
Compound name
(2Z)-2-hydroxyimino-1,2-bis(1-methylindol-3-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

331.13208 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.13936 178.0
[M+Na]+ 354.12130 188.7
[M-H]- 330.12480 186.0
[M+NH4]+ 349.16590 194.7
[M+K]+ 370.09524 183.2
[M+H-H2O]+ 314.12934 169.8
[M+HCOO]- 376.13028 201.4
[M+CH3COO]- 390.14593 190.2
[M+Na-2H]- 352.10675 180.5
[M]+ 331.13153 183.3
[M]- 331.13263 183.3
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.