2-Oxabicyclo[2.2.1]heptane-1-carboxylic acid, 4,7,7-trimethyl-3-oxo-, 3-(acetyloxy)-1-methyl-2-nitrobutyl ester, [1S-[1.alpha.(1S*,2S*,3R*),4.beta.]]-

SpectraBase Compound ID	10GUZKhKhiv
InChI	InChI=1S/C17H25NO8/c1-9(24-11(3)19)12(18(22)23)10(2)25-14(21)17-8-7-16(6,13(20)26-17)15(17,4)5/h9-10,12H,7-8H2,1-6H3/t9?,10?,12?,16-,17+/m0/s1
InChIKey	REONKZWDMBGMNZ-BHWQPEONSA-N Google Search
Mol Weight	371.39 g/mol
Molecular Formula	C17H25NO8
Exact Mass	371.158017 g/mol

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SpectraBase Spectrum ID	N9nnu6L55T
Name	2-Oxabicyclo[2.2.1]heptane-1-carboxylic acid, 4,7,7-trimethyl-3-oxo-, 3-(acetyloxy)-1-methyl-2-nitrobutyl ester, [1S-[1.alpha.(1S,2S,3R*),4.beta.]]-
Alternate Name(s)	2-O-Acetyl-1,3,5-trideoxy-3-nitro-4-O-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl)carbonyl]pentitol (3-acetoxy-1-methyl-2-nitro-butyl) 1,7,7-trimethyl-2-oxo-3-oxabicyclo[2.2.1]heptane-4-carboxylate (4-acetyloxy-3-nitro-pentan-2-yl) 1,7,7-trimethyl-2-oxidanylidene-3-oxabicyclo[2.2.1]heptane-4-carboxylate (4-acetyloxy-3-nitropentan-2-yl) 1,7,7-trimethyl-2-oxo-3-oxabicyclo[2.2.1]heptane-4-carboxylate 1,7,7-trimethyl-2-oxo-3-oxabicyclo[2.2.1]heptane-4-carboxylic acid (4-acetyloxy-3-nitropentan-2-yl) ester 2-keto-1,7,7-trimethyl-3-oxabicyclo[2.2.1]heptane-4-carboxylic acid (3-acetoxy-1-methyl-2-nitro-butyl) ester
CAS Registry Number	114455-02-6
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H25NO8
InChI	InChI=1S/C17H25NO8/c1-9(24-11(3)19)12(18(22)23)10(2)25-14(21)17-8-7-16(6,13(20)26-17)15(17,4)5/h9-10,12H,7-8H2,1-6H3/t9?,10?,12?,16-,17+/m0/s1
InChIKey	REONKZWDMBGMNZ-BHWQPEONSA-N
Molecular Weight	371.386 g/mol
SMILES	C(N(=O)=O)(C(OC([C@]12CC[C@@](C(O2)=O)(C1(C)C)C)=O)C)C(C)OC(=O)C
SPLASH	splash10-052f-9600000000-daf63ae80f615132e1b6
Wiley ID	1485486