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(3S,4R)-4-(Benzo[d][1,3]dioxol-5-ylmethyl)-3-((S)-hydroxy(4-nitrophenyl)methyl)- dihydrofuran-2(3H)-one
SpectraBase Compound ID I72BH8QxJPe
InChI InChI=1S/C19H17NO7/c21-18(12-2-4-14(5-3-12)20(23)24)17-13(9-25-19(17)22)7-11-1-6-15-16(8-11)27-10-26-15/h1-6,8,13,17-18,21H,7,9-10H2/t13-,17-,18+/m0/s1
InChIKey SOALSOCFLGLPKW-DOPJRALCSA-N
Mol Weight 371.35 g/mol
Molecular Formula C19H17NO7
Exact Mass 371.100502 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4FGSJpEoGD6
Name (3S,4R)-4-(Benzo[d][1,3]dioxol-5-ylmethyl)-3-((S)-hydroxy(4-nitrophenyl)methyl)- dihydrofuran-2(3H)-one
Alternate Name(s) (3S,4R)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(S)-hydroxy-(4-nitrophenyl)methyl]-2-oxolanone (3S,4R)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(S)-hydroxy-(4-nitrophenyl)methyl]oxolan-2-one (3S,4R)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(S)-hydroxy-(4-nitrophenyl)methyl]tetrahydrofuran-2-one (3S,4R)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(S)-(4-nitrophenyl)-oxidanyl-methyl]oxolan-2-one
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Formula C19H17NO7
InChI InChI=1S/C19H17NO7/c21-18(12-2-4-14(5-3-12)20(23)24)17-13(9-25-19(17)22)7-11-1-6-15-16(8-11)27-10-26-15/h1-6,8,13,17-18,21H,7,9-10H2/t13-,17-,18+/m0/s1
InChIKey SOALSOCFLGLPKW-DOPJRALCSA-N
Molecular Weight 371.345 g/mol
SMILES O[C@@]([C@]1(C(OC[C@@]1(Cc1cc2OCOc2cc1)[H])=O)[H])(c1ccc(N(=O)=O)cc1)[H]
SPLASH splash10-0671-7961000000-8190c58264145fafbc46
Source of Spectrum F2-45-5982-6d
Wiley ID 1703516