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Acetic acid (1R,4R)-4-[benzenesulfonyl-(2-methyl-allyl)-amino]-cyclohex-2-enyl ester
SpectraBase Compound ID 4dv4CwCWjiI
InChI InChI=1S/C18H23NO4S/c1-14(2)13-19(24(21,22)18-7-5-4-6-8-18)16-9-11-17(12-10-16)23-15(3)20/h4-9,11,16-17H,1,10,12-13H2,2-3H3/t16-,17-/m0/s1
InChIKey YSYUVSPTZDIJNZ-IRXDYDNUSA-N
Mol Weight 349.45 g/mol
Molecular Formula C18H23NO4S
Exact Mass 349.134779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9A6ezxuC7xw
Name Acetic acid (1R,4R)-4-[benzenesulfonyl-(2-methyl-allyl)-amino]-cyclohex-2-enyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23NO4S
InChI InChI=1S/C18H23NO4S/c1-14(2)13-19(24(21,22)18-7-5-4-6-8-18)16-9-11-17(12-10-16)23-15(3)20/h4-9,11,16-17H,1,10,12-13H2,2-3H3/t16-,17-/m0/s1
InChIKey YSYUVSPTZDIJNZ-IRXDYDNUSA-N
Molecular Weight 349.445 g/mol
SMILES [C@@]1(N(S(=O)(=O)c2ccccc2)CC(=C)C)(C=C[C@](OC(=O)C)(CC1)[H])[H]
SPLASH splash10-000i-1690000000-db1d8a3560774981aff4
Source of Spectrum F-53-11824-49
Synonyms (1R,4R)-4-[(2-methyl-2-propenyl)(phenylsulfonyl)amino]-2-cyclohexen-1-yl acetate trans-1-Acetoxy-4-(N-phenylsulfonyl-N-methylallyl)cyclohex-2-ene
Wiley ID 803363