Methyl (2R,4S,6S,12bR)-4-(4-fluorophenyl)-2-[(2-thienylmethyl)amino]-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizine-6-carboxylate

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Systematic / IUPAC Name: Methyl (2R,4S,6S,12bR)-4-(4-fluorophenyl)-2-(thiophen-2-ylmethylamino)-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizine-6-carboxylate

ID: Reference9138

Other Names: Indolo[2,3-a]quinolizine-6-carboxylic acid, 4-(4-fluorophenyl)-1,2,3,4,6,7,12,12b-octahydro-2-[(2-thienylmethyl)amino]-, methyl ester, (2R,4S,6S,12bR)-;
NAT15-330442

Formula: C28H28FN3O2S

Spectral Data

Methyl (2R,4S,6S,12bR)-4-(4-fluorophenyl)-2-[(2-thienylmethyl)amino]-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizine-6-carboxylate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP FAIMS
No. of Spectral Trees 1
No. of Spectra 3972
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6, MS7
Ionization Methods NSI
Analyzers FT
Last Modification 11/22/2019 10:52:39 AM
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Identificators

InChI InChI=1S/C28H28FN3O2S/c1-34-28(33)26-15-22-21-6-2-3-7-23(21)31-27(22)25-14-19(30-16-20-5-4-12-35-20)13-24(32(25)26)17-8-10-18(29)11-9-17/h2-12,19,24-26,30-31H,13-16H2,1H3/t19-,24+,25-,26+/m1/s1
InChI Key WEZSMQLACBBAJC-IWRQBJDLSA-N
Canonical SMILES COC(=O)C1CC2=C(C3N1C(CC(C3)NCC4=CC=CS4)C5=CC=C(C=C5)F)NC6=CC=CC=C26
CAS
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Other Names Indolo[2,3-a]quinolizine-6-carboxylic acid, 4-(4-fluorophenyl)-1,2,3,4,6,7,12,12b-octahydro-2-[(2-thienylmethyl)amino]-, methyl ester, (2R,4S,6S,12bR)-;
NAT15-330442

In Other Databases

ChemSpider 21385336
PubChem 28991368