CID 15958935

Schembl12229896

Structural Information

Molecular Formula
C16H15N2O3P
SMILES
COP(=O)(C1=CC=CC=C1)C2=C(NC3=CC=CC=C32)C(=O)N
InChI
InChI=1S/C16H15N2O3P/c1-21-22(20,11-7-3-2-4-8-11)15-12-9-5-6-10-13(12)18-14(15)16(17)19/h2-10,18H,1H3,(H2,17,19)
InChIKey
VVUYJKRJOODPHJ-UHFFFAOYSA-N
Compound name
3-[methoxy(phenyl)phosphoryl]-1H-indole-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

314.08203 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.08931 172.0
[M+Na]+ 337.07125 179.5
[M-H]- 313.07475 176.0
[M+NH4]+ 332.11585 186.8
[M+K]+ 353.04519 175.1
[M+H-H2O]+ 297.07929 161.9
[M+HCOO]- 359.08023 198.3
[M+CH3COO]- 373.09588 204.9
[M+Na-2H]- 335.05670 173.7
[M]+ 314.08148 172.8
[M]- 314.08258 172.8
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

patents stripe