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N-[(Z,1S)-1-methylolnonadec-4-enyl]carbamic acid tert-butyl ester
SpectraBase Compound ID Gg6C6PLt77U
InChI InChI=1S/C25H49NO3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23(22-27)26-24(28)29-25(2,3)4/h18-19,23,27H,5-17,20-22H2,1-4H3,(H,26,28)/b19-18-/t23-/m0/s1
InChIKey KTXQPOYDMQGGBY-HYFYUXENSA-N
Mol Weight 411.7 g/mol
Molecular Formula C25H49NO3
Exact Mass 411.371244 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EY3cFZscwCE
Name N-[(Z,1S)-1-methylolnonadec-4-enyl]carbamic acid tert-butyl ester
Alternate Name(s) N-[(Z,2S)-1-hydroxyeicos-5-en-2-yl]carbamic acid tert-butyl ester tert-Butyl N-[(Z,1S)-1-(hydroxymethyl)nonadec-4-enyl]carbamate tert-Butyl N-[(Z,2S)-1-hydroxyicos-5-en-2-yl]carbamate tert-Butyl N-[(Z,2S)-1-oxidanylicos-5-en-2-yl]carbamate
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Formula C25H49NO3
InChI InChI=1S/C25H49NO3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23(22-27)26-24(28)29-25(2,3)4/h18-19,23,27H,5-17,20-22H2,1-4H3,(H,26,28)/b19-18-/t23-/m0/s1
InChIKey KTXQPOYDMQGGBY-HYFYUXENSA-N
Molecular Weight 411.671 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@](CO)(CC\C=C/CCCCCCCCCCCCCC)[H]
SPLASH splash10-0a4i-9012000000-64a7eefd15fbaed272a8
Source of Spectrum J-63-3744-12
Wiley ID 1374166