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(S,R)-(1-Chlorosulfonyl-2-phenylethyl)pentyl]carbamic acid methyl ester

View entire compound with spectra: 1 MS (GC)

(S,R)-(1-Chlorosulfonyl-2-phenylethyl)pentyl]carbamic acid methyl ester
SpectraBase Compound ID 8y9r7MsFTDX
InChI InChI=1S/C15H22ClNO4S/c1-3-4-10-13(17-15(18)21-2)14(22(16,19)20)11-12-8-6-5-7-9-12/h5-9,13-14H,3-4,10-11H2,1-2H3,(H,17,18)/t13-,14+/m1/s1
InChIKey COEGCOFJYIOQJA-KGLIPLIRSA-N
Mol Weight 347.86 g/mol
Molecular Formula C15H22ClNO4S
Exact Mass 347.095807 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HBJ2O1shIkW
Name (S,R)-(1-Chlorosulfonyl-2-phenylethyl)pentyl]carbamic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22ClNO4S
InChI InChI=1S/C15H22ClNO4S/c1-3-4-10-13(17-15(18)21-2)14(22(16,19)20)11-12-8-6-5-7-9-12/h5-9,13-14H,3-4,10-11H2,1-2H3,(H,17,18)/t13-,14+/m1/s1
InChIKey COEGCOFJYIOQJA-KGLIPLIRSA-N
Molecular Weight 347.857 g/mol
SMILES N(C(=O)OC)[C@@]([C@@](S(=O)(=O)Cl)(Cc1ccccc1)[H])(CCCC)[H]
SPLASH splash10-0006-3900000000-ed8771aba7a76cedf5cc
Source of Spectrum C5-2002-1812-4
Wiley ID 1617764