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2-[2-[(1-besylpyrrol-2-yl)methyl]-1,3-dioxan-2-yl]acetic acid methyl ester
SpectraBase Compound ID 9slAUutgAaI
InChI InChI=1S/C18H21NO6S/c1-23-17(20)14-18(24-11-6-12-25-18)13-15-7-5-10-19(15)26(21,22)16-8-3-2-4-9-16/h2-5,7-10H,6,11-14H2,1H3
InChIKey UUPGLFPJPBJEGM-UHFFFAOYSA-N
Mol Weight 379.43 g/mol
Molecular Formula C18H21NO6S
Exact Mass 379.108959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F8Cq7sLZSsT
Name 2-[2-[(1-besylpyrrol-2-yl)methyl]-1,3-dioxan-2-yl]acetic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NO6S
InChI InChI=1S/C18H21NO6S/c1-23-17(20)14-18(24-11-6-12-25-18)13-15-7-5-10-19(15)26(21,22)16-8-3-2-4-9-16/h2-5,7-10H,6,11-14H2,1H3
InChIKey UUPGLFPJPBJEGM-UHFFFAOYSA-N
Molecular Weight 379.427 g/mol
SMILES c1([n](S(=O)(=O)c2ccccc2)ccc1)CC1(CC(=O)OC)OCCCO1
SPLASH splash10-0a4i-2900000000-6213ca32408197046ef6
Source of Spectrum E1-40-2350-37
Synonyms 2-[2-[[1-(benzenesulfonyl)-2-pyrrolyl]methyl]-1,3-dioxan-2-yl]acetic acid methyl ester Methyl 2-[2-[[1-(benzenesulfonyl)pyrrol-2-yl]methyl]-1,3-dioxan-2-yl]acetate Methyl 2-[2-[[1-(phenylsulfonyl)pyrrol-2-yl]methyl]-1,3-dioxan-2-yl]ethanoate
Wiley ID 1519642