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(R,R)-1,1-Diethoxynon-2-yn-4-yl N-1-(phenylethyl)carbamate
SpectraBase Compound ID KP5VMTURllO
InChI InChI=1S/C22H33NO4/c1-5-8-10-15-20(16-17-21(25-6-2)26-7-3)27-22(24)23-18(4)19-13-11-9-12-14-19/h9,11-14,18,20-21H,5-8,10,15H2,1-4H3,(H,23,24)/t18-,20?/m1/s1
InChIKey RSHDMMDHROOBCC-QSVWIEALSA-N
Mol Weight 375.5 g/mol
Molecular Formula C22H33NO4
Exact Mass 375.240959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F52lTfrflUf
Name (R,R)-1,1-Diethoxynon-2-yn-4-yl N-1-(phenylethyl)carbamate
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Formula C22H33NO4
InChI InChI=1S/C22H33NO4/c1-5-8-10-15-20(16-17-21(25-6-2)26-7-3)27-22(24)23-18(4)19-13-11-9-12-14-19/h9,11-14,18,20-21H,5-8,10,15H2,1-4H3,(H,23,24)/t18-,20?/m1/s1
InChIKey RSHDMMDHROOBCC-QSVWIEALSA-N
Molecular Weight 375.509 g/mol
SMILES N(C(OC(C#CC(OCC)OCC)CCCCC)=O)[C@@](c1ccccc1)(C)[H]
SPLASH splash10-0a59-0902000000-6af0a57cb1291784ff71
Source of Spectrum F-50-10250-8
Synonyms ((R)-1-Phenyl-ethyl)-carbamic acid-1-(3,3-diethoxy-prop-1-ynyl)-hexylester
Wiley ID 789265