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Benzyl (S)-N-(4-Chloro-3-hydroxybutyl)carbamate

View entire compound with spectra: 1 MS (GC)

Benzyl (S)-N-(4-Chloro-3-hydroxybutyl)carbamate
SpectraBase Compound ID 8zkzcyCWBpQ
InChI InChI=1S/C12H16ClNO3/c13-8-11(15)6-7-14-12(16)17-9-10-4-2-1-3-5-10/h1-5,11,15H,6-9H2,(H,14,16)/t11-/m1/s1
InChIKey RODXHDMTLCWPLY-LLVKDONJSA-N
Mol Weight 257.72 g/mol
Molecular Formula C12H16ClNO3
Exact Mass 257.081871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2LGVqhP2eWL
Name Benzyl (S)-N-(4-Chloro-3-hydroxybutyl)carbamate
Alternate Name(s) benzyl (3S)-4-chloro-3-hydroxybutylcarbamate Benzyl (R)-N-(4-Chloro-3-hydroxybutyl)carbamate
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Formula C12H16ClNO3
InChI InChI=1S/C12H16ClNO3/c13-8-11(15)6-7-14-12(16)17-9-10-4-2-1-3-5-10/h1-5,11,15H,6-9H2,(H,14,16)/t11-/m1/s1
InChIKey RODXHDMTLCWPLY-LLVKDONJSA-N
Molecular Weight 257.717 g/mol
SMILES N(C(=O)OCc1ccccc1)CC[C@@](O)(CCl)[H]
SPLASH splash10-052f-9700000000-3b693096b6828f5166dc
Source of Spectrum QC-10-724-3
Wiley ID 871095