CID 6917973

Vintoperol

Structural Information

Molecular Formula
C18H24N2O
SMILES
CC[C@@]1(CCCN2[C@@H]1C3=C(CC2)C4=CC=CC=C4N3)CO
InChI
InChI=1S/C18H24N2O/c1-2-18(12-21)9-5-10-20-11-8-14-13-6-3-4-7-15(13)19-16(14)17(18)20/h3-4,6-7,17,19,21H,2,5,8-12H2,1H3/t17-,18-/m1/s1
InChIKey
BKRBRZLECKMEBD-QZTJIDSGSA-N
Compound name
[(1S,12bS)-1-ethyl-3,4,6,7,12,12b-hexahydro-2H-indolo[2,3-a]quinolizin-1-yl]methanol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

8
References

425
Patents

284.18887 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.19615 169.1
[M+Na]+ 307.17809 176.6
[M-H]- 283.18159 169.4
[M+NH4]+ 302.22269 187.8
[M+K]+ 323.15203 169.3
[M+H-H2O]+ 267.18613 160.9
[M+HCOO]- 329.18707 180.9
[M+CH3COO]- 343.20272 178.4
[M+Na-2H]- 305.16354 173.3
[M]+ 284.18832 165.1
[M]- 284.18942 165.1
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.