MMB018

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Systematic / IUPAC Name: Methyl N-[(1-pentyl-1H-indol-3-yl)carbonyl]-L-valinate

ID: Reference5798

Other Names: L-Valine, N-[(1-pentyl-1H-indol-3-yl)carbonyl], methyl ester;
Methyl (1-pentyl-1H-indole-3-carbonyl)-L-valinate

Formula: C20H28N2O3

Class: Drugs of Abuse/Illegal Drugs

Spectral Data

MMB018 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 Q Exactive Plus Orbitrap
No. of Spectral Trees 1
No. of Spectra 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 10/20/2016 12:26:18 PM
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Identificators

InChI InChI=1S/C20H28N2O3/c1-5-6-9-12-22-13-16(15-10-7-8-11-17(15)22)19(23)21-18(14(2)3)20(24)25-4/h7-8,10-11,13-14,18H,5-6,9,12H2,1-4H3,(H,21,23)/t18-/m0/s1
InChI Key XOVHYVWQBVNONJ-SFHVURJKSA-N
Canonical SMILES O=C(N[C@H](C(OC)=O)C(C)C)C1=CN(CCCCC)C2=C1C=CC=C2
CAS
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Other Names L-Valine, N-[(1-pentyl-1H-indol-3-yl)carbonyl], methyl ester;
Methyl (1-pentyl-1H-indole-3-carbonyl)-L-valinate

In Other Databases

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