4-Acetamido-N-({(1S,4S,6S)-4-[2-(cyclopentylamino)-2-oxoethyl]-6-isopropyl-3-methyl-2-cyclohexen-1-yl}methyl)benzamide

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Systematic / IUPAC Name: 4-Acetamido-N-[[(1S,4S,6S)-4-[2-(cyclopentylamino)-2-oxoethyl]-3-methyl-6-propan-2-ylcyclohex-2-en-1-yl]methyl]benzamide

ID: Reference10453

Other Names: Benzamide, 4-(acetylamino)-N-[[(1S,4S,6S)-4-[2-(cyclopentylamino)-2-oxoethyl]-3-methyl-6-(1-methylethyl)-2-cyclohexen-1-yl]methyl]-;
NAT28-403263

Formula: C27H39N3O3

Spectral Data

4-Acetamido-N-({(1S,4S,6S)-4-[2-(cyclopentylamino)-2-oxoethyl]-6-isopropyl-3-methyl-2-cyclohexen-1-yl}methyl)benzamide 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
No. of Spectral Trees 2
No. of Spectra 5263
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 5/14/2021 8:45:51 AM
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Identificators

InChI InChI=1S/C27H39N3O3/c1-17(2)25-14-21(15-26(32)30-23-7-5-6-8-23)18(3)13-22(25)16-28-27(33)20-9-11-24(12-10-20)29-19(4)31/h9-13,17,21-23,25H,5-8,14-16H2,1-4H3,(H,28,33)(H,29,31)(H,30,32)/t21-,22-,25-/m0/s1
InChI Key WLUZQTABXXWRJO-HWBMXIPRSA-N
Canonical SMILES CC1=CC(C(CC1CC(=O)NC2CCCC2)C(C)C)CNC(=O)C3=CC=C(C=C3)NC(=O)C
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Other Names Benzamide, 4-(acetylamino)-N-[[(1S,4S,6S)-4-[2-(cyclopentylamino)-2-oxoethyl]-3-methyl-6-(1-methylethyl)-2-cyclohexen-1-yl]methyl]-;
NAT28-403263

In Other Databases

PubChem 45783868
ChemSpider 29849326