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Reserpine

View entire compound with spectra: 4 NMR, 2 FTIR, 2 Raman, and 3 MS (GC)

Reserpine
SpectraBase Compound ID HkI99YVTXDQ
InChI InChI=1S/C33H40N2O9/c1-38-19-7-8-20-21-9-10-35-16-18-13-27(44-32(36)17-11-25(39-2)30(41-4)26(12-17)40-3)31(42-5)28(33(37)43-6)22(18)15-24(35)29(21)34-23(20)14-19/h7-8,11-12,14,18,22,24,27-28,31,34H,9-10,13,15-16H2,1-6H3/t18-,22+,24-,27-,28+,31+/m1/s1
InChIKey QEVHRUUCFGRFIF-MDEJGZGSSA-N
Mol Weight 608.7 g/mol
Molecular Formula C33H40N2O9
Exact Mass 608.273381 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID D0sLATcqXEA
Name Reserpine
Source of Sample Alltech Associates, Inc., Grace Davison Discovery Sciences
Catalog Number 01243
Lot Number 422
Accessory DurasamplIR II
CAS Registry Number 50-55-5
Classification Antihypertensive
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H44N2O9
InChI InChI=1S/C33H40N2O9/c1-38-19-7-8-20-21-9-10-35-16-18-13-27(44-32(36)17-11-25(39-2)30(41-4)26(12-17)40-3)31(42-5)28(33(37)43-6)22(18)15-24(35)29(21)34-23(20)14-19/h7-8,11-12,14,18,22,24,27-28,31,34H,9-10,13,15-16H2,1-6H3/t18-,22+,24-,27-,28+,31+/m1/s1
InChIKey QEVHRUUCFGRFIF-MDEJGZGSSA-N
Instrument Name Bio-Rad FTS
Source of Spectrum Forensic Spectral Research
Synonyms 3beta,20alpha-Yohimban-16beta-carboxylic acid, 18beta-hydroxy-11,17alpha-dimethoxy- methyl ester 3,4,5-trimethoxybenzoate (ester)
Technique ATR-Neat (DuraSamplIR II)