CID 10192617

Indantadol

Structural Information

Molecular Formula
C11H14N2O
SMILES
C1C(CC2=CC=CC=C21)NCC(=O)N
InChI
InChI=1S/C11H14N2O/c12-11(14)7-13-10-5-8-3-1-2-4-9(8)6-10/h1-4,10,13H,5-7H2,(H2,12,14)
InChIKey
MNLULKBKWKTZPE-UHFFFAOYSA-N
Compound name
2-(2,3-dihydro-1H-inden-2-ylamino)acetamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

20
References

794
Patents

190.11061 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.11789 141.7
[M+Na]+ 213.09983 150.9
[M+NH4]+ 208.14443 150.3
[M+K]+ 229.07377 146.8
[M-H]- 189.10333 144.4
[M+Na-2H]- 211.08528 146.3
[M]+ 190.11006 143.4
[M]- 190.11116 143.4
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