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(1R,6S,7R,Z)-7-Isopropyl-9-[(S)-N-methyl-S-phenyl-sulfonimidoyl)]-10-oxabicyclo-[4.3.1]deca-4,8-dien-1-ol
SpectraBase Compound ID XrMSjNKXiN
InChI InChI=1S/C19H25NO3S/c1-14(2)16-13-18(19(21)12-8-7-11-17(16)23-19)24(22,20-3)15-9-5-4-6-10-15/h4-7,9-11,13-14,16-17,21H,8,12H2,1-3H3/t16-,17-,19+,24+/m0/s1
InChIKey SFQMTRYEGZJFTI-MDWCYVBFSA-N
Mol Weight 347.47 g/mol
Molecular Formula C19H25NO3S
Exact Mass 347.155515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8seKkww29Sl
Name (1R,6S,7R,Z)-7-Isopropyl-9-[(S)-N-methyl-S-phenyl-sulfonimidoyl)]-10-oxabicyclo-[4.3.1]deca-4,8-dien-1-ol
Alternate Name(s) (1R,6S,7R)-7-isopropyl-9-(N-methylphenylsulfonimidoyl)-10-oxabicyclo[4.3.1]deca-4,8-dien-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H25NO3S
InChI InChI=1S/C19H25NO3S/c1-14(2)16-13-18(19(21)12-8-7-11-17(16)23-19)24(22,20-3)15-9-5-4-6-10-15/h4-7,9-11,13-14,16-17,21H,8,12H2,1-3H3/t16-,17-,19+,24+/m0/s1
InChIKey SFQMTRYEGZJFTI-MDWCYVBFSA-N
Literature Reference DOI 10.1021/ol800854s
Molecular Weight 347.473 g/mol
SMILES O[C@]12O[C@@]([H])(C=CCC2)[C@](C(C)C)(C=C1[S@](=NC)(=O)c1ccccc1)[H]
SPLASH splash10-0a6r-0902000000-8b65fb7eb7383c838c5b
Source of Spectrum A1-10-2713/SMS27-18
Wiley ID 1759558