CID 199255

Galanthamine methiodide

Structural Information

Molecular Formula
C18H24NO3
SMILES
C[N+]1(CCC23C=C[C@@H](C[C@@H]2OC4=C(C=CC(=C34)C1)OC)O)C
InChI
InChI=1S/C18H24NO3/c1-19(2)9-8-18-7-6-13(20)10-15(18)22-17-14(21-3)5-4-12(11-19)16(17)18/h4-7,13,15,20H,8-11H2,1-3H3/q+1/t13-,15-,18?/m0/s1
InChIKey
FESJTOGKKMDYHG-SUAWAIIZSA-N
Compound name
(12S,14R)-9-methoxy-4,4-dimethyl-11-oxa-4-azoniatetracyclo[8.6.1.01,12.06,17]heptadeca-6(17),7,9,15-tetraen-14-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

302.17563 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.18291 171.5
[M+Na]+ 325.16485 178.7
[M-H]- 301.16835 177.2
[M+NH4]+ 320.20945 191.0
[M+K]+ 341.13879 171.8
[M+H-H2O]+ 285.17289 167.6
[M+HCOO]- 347.17383 183.7
[M+CH3COO]- 361.18948 197.9
[M+Na-2H]- 323.15030 178.2
[M]+ 302.17508 168.6
[M]- 302.17618 168.6
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.