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1-(2-ANILINO-2-METHYLETHYL)-4-PHENETHYLPIPERAZINE, OXALATE (1:2), HEMIHYDRATE

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1-(2-ANILINO-2-METHYLETHYL)-4-PHENETHYLPIPERAZINE, OXALATE (1:2), HEMIHYDRATE
SpectraBase Compound ID 7ZL40Ci8OGh
InChI InChI=1S/2C21H29N3.4C2H2O4.H2O/c2*1-19(22-21-10-6-3-7-11-21)18-24-16-14-23(15-17-24)13-12-20-8-4-2-5-9-20;4*3-1(4)2(5)6;/h2*2-11,19,22H,12-18H2,1H3;4*(H,3,4)(H,5,6);1H2
InChIKey JUSWUJYKLPMINS-UHFFFAOYSA-N
Mol Weight 512.559 g/mol
Molecular Formula C25H33N3O8·½H2O
Exact Mass 512.232047 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID INdxHjDclUD
Name 1-(2-ANILINO-2-METHYLETHYL)-4-PHENETHYLPIPERAZINE, OXALATE (1:2), HEMIHYDRATE
Source of Sample J. Okada, Kyoto University, Kyoto, Japan
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C50H68N6O17
InChI InChI=1S/2C21H29N3.4C2H2O4.H2O/c2*1-19(22-21-10-6-3-7-11-21)18-24-16-14-23(15-17-24)13-12-20-8-4-2-5-9-20;4*3-1(4)2(5)6;/h2*2-11,19,22H,12-18H2,1H3;4*(H,3,4)(H,5,6);1H2
InChIKey JUSWUJYKLPMINS-UHFFFAOYSA-N
Literature Reference CHEM. PHARM. BULL. TOKYO 28, 3315(1980) Abstract-Chemical Abstracts= 94, 192270(1981)
Melting Point 207-208C
Molecular Weight 1025.119019
Synonyms PIPERAZINE, 1-/2-ANILINO-2-METHYL- ETHYL/-4-PHENETHYL-, OXALATE /1 TO 2/, HEMIHYDRATE
Technique KBr WAFER