CID 9881504

Eslicarbazepine

Structural Information

Molecular Formula
C15H14N2O2
SMILES
C1[C@@H](C2=CC=CC=C2N(C3=CC=CC=C31)C(=O)N)O
InChI
InChI=1S/C15H14N2O2/c16-15(19)17-12-7-3-1-5-10(12)9-14(18)11-6-2-4-8-13(11)17/h1-8,14,18H,9H2,(H2,16,19)/t14-/m0/s1
InChIKey
BMPDWHIDQYTSHX-AWEZNQCLSA-N
Compound name
(5S)-5-hydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide
Related CIDs

2D Structure

compound 2d structure
8
Annotation Hits

79
References

1853
Patents

254.10553 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.11281 154.8
[M+Na]+ 277.09475 161.9
[M-H]- 253.09825 158.9
[M+NH4]+ 272.13935 170.8
[M+K]+ 293.06869 162.0
[M+H-H2O]+ 237.10279 149.0
[M+HCOO]- 299.10373 172.6
[M+CH3COO]- 313.11938 165.9
[M+Na-2H]- 275.08020 160.8
[M]+ 254.10498 150.0
[M]- 254.10608 150.0
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.