Systematic / IUPAC Name: 2-[(3R,4S)-1-(2-Methoxyacetyl)-3-[2-(4-phenylpiperazin-1-yl)ethyl]piperidin-4-yl]acetic acid
ID: Reference10946
Other Names:
4-Piperidineacetic acid, 1-(2-methoxyacetyl)-3-[2-(4-phenyl-1-piperazinyl)ethyl]-, (3R,4S)-;
NAT14-336293
Formula: C22H33N3O4
{(3R,4S)-1-(Methoxyacetyl)-3-[2-(4-phenyl-1-piperazinyl)ethyl]-4-piperidinyl}acetic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
No. of Spectral Trees | 1 |
No. of Spectra | 2552 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 10/15/2021 10:31:37 AM |
InChI | InChI=1S/C22H33N3O4/c1-29-17-21(26)25-10-8-18(15-22(27)28)19(16-25)7-9-23-11-13-24(14-12-23)20-5-3-2-4-6-20/h2-6,18-19H,7-17H2,1H3,(H,27,28)/t18-,19-/m0/s1 |
InChI Key | NCRUTGSGXOUZQW-OALUTQOASA-N |
Canonical SMILES | COCC(=O)N1CCC(C(C1)CCN2CCN(CC2)C3=CC=CC=C3)CC(=O)O |
CAS | |
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Other Names |
4-Piperidineacetic acid, 1-(2-methoxyacetyl)-3-[2-(4-phenyl-1-piperazinyl)ethyl]-, (3R,4S)-; NAT14-336293 |