[(3R,4S)-3-[(6-Methoxy-3,4-dihydro-1-isoquinolinyl)methyl]-1-(4-morpholinylcarbonyl)-4-piperidinyl]acetic acid

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Systematic / IUPAC Name: 2-[(3R,4S)-3-[(6-Methoxy-3,4-dihydroisoquinolin-1-yl)methyl]-1-(morpholine-4-carbonyl)piperidin-4-yl]acetic acid

ID: Reference8838

Other Names: 4-Piperidineacetic acid, 3-[(3,4-dihydro-6-methoxy-1-isoquinolinyl)methyl]-1-(4-morpholinylcarbonyl)-, (3R,4S)-;
NAT14-502099

Formula: C23H31N3O5

Spectral Data

[(3R,4S)-3-[(6-Methoxy-3,4-dihydro-1-isoquinolinyl)methyl]-1-(4-morpholinylcarbonyl)-4-piperidinyl]acetic acid 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 2035
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6, MS7
Ionization Methods NSI
Analyzers FT
Last Modification 8/9/2019 8:41:36 AM
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Identificators

InChI InChI=1S/C23H31N3O5/c1-30-19-2-3-20-17(12-19)4-6-24-21(20)13-18-15-26(7-5-16(18)14-22(27)28)23(29)25-8-10-31-11-9-25/h2-3,12,16,18H,4-11,13-15H2,1H3,(H,27,28)/t16-,18-/m0/s1
InChI Key CYSRAQWUZAZTGW-WMZOPIPTSA-N
Canonical SMILES COC1=CC2=C(C=C1)C(=NCC2)CC3CN(CCC3CC(=O)O)C(=O)N4CCOCC4
CAS
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Other Names 4-Piperidineacetic acid, 3-[(3,4-dihydro-6-methoxy-1-isoquinolinyl)methyl]-1-(4-morpholinylcarbonyl)-, (3R,4S)-;
NAT14-502099

In Other Databases

ChemSpider 29857381
PubChem 51136661