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3-Oxazolidinecarboxylic acid, 4-(1-hydroxy-4,4-dimethoxy-2-butenyl)-2,2-dimethyl-, 1,1-dimethylethyl ester, [S-[R*,S*-(Z)]]-
SpectraBase Compound ID EQSP0lKVIPh
InChI InChI=1S/C16H29NO6/c1-15(2,3)23-14(19)17-11(10-22-16(17,4)5)12(18)8-9-13(20-6)21-7/h8-9,11-13,18H,10H2,1-7H3/b9-8-/t11-,12+/m1/s1
InChIKey CPSGXTNVNRVDEM-STNFYNBXSA-N
Mol Weight 331.41 g/mol
Molecular Formula C16H29NO6
Exact Mass 331.199488 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5DRMa5HXTnV
Name 3-Oxazolidinecarboxylic acid, 4-(1-hydroxy-4,4-dimethoxy-2-butenyl)-2,2-dimethyl-, 1,1-dimethylethyl ester, [S-[R*,S*-(Z)]]-
Alternate Name(s) 1,1-Dimethylethyl[s-[r(*),s(*)-(Z)]]-4-(1-hydroxy-4,4-dimethoxy-2-brtenyl)-2,2-dimethyl-3-oxazolidinecarboxylate 1,1-Dimethylethyl[S-[R(*),S(*)-(Z)]]-4-(1-Hydroxy-4,4-dimethoxy-2-butenyl)-2,2-dimethyl-3-oxazolidinecarboxylate tert-Butyl (4R)-4-[(1S,2Z)-1-hydroxy-4,4-dimethoxy-2-butenyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate
CAS Registry Number 127256-95-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H29NO6
InChI InChI=1S/C16H29NO6/c1-15(2,3)23-14(19)17-11(10-22-16(17,4)5)12(18)8-9-13(20-6)21-7/h8-9,11-13,18H,10H2,1-7H3/b9-8-/t11-,12+/m1/s1
InChIKey CPSGXTNVNRVDEM-STNFYNBXSA-N
Molecular Weight 331.409 g/mol
SMILES O[C@@](\C=C/C(OC)OC)([C@@]1(N(C(OC(C)(C)C)=O)C(OC1)(C)C)[H])[H]
SPLASH splash10-0udi-0960000000-5ac786af55ef0c74ace8
Source of Spectrum J-55-3779-10
Wiley ID 1328599