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2(3H)-Furanone, 3-[(dimethylamino)methylene]-5-(2,2-dimethyl-1,3-dioxolan-4-yl)dihydro-, [S-[R*,S*-(E)]]-
SpectraBase Compound ID DrMfIoyihJL
InChI InChI=1S/C12H19NO4/c1-12(2)15-7-10(17-12)9-5-8(6-13(3)4)11(14)16-9/h6,9-10H,5,7H2,1-4H3/b8-6+/t9-,10+/m1/s1
InChIKey UVEHLGSFDUHKJH-ZQMPTTJKSA-N
Mol Weight 241.29 g/mol
Molecular Formula C12H19NO4
Exact Mass 241.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7TLr3JXu8Gu
Name 2(3H)-Furanone, 3-[(dimethylamino)methylene]-5-(2,2-dimethyl-1,3-dioxolan-4-yl)dihydro-, [S-[R*,S*-(E)]]-
CAS Registry Number 128856-62-2
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H19NO4
InChI InChI=1S/C12H19NO4/c1-12(2)15-7-10(17-12)9-5-8(6-13(3)4)11(14)16-9/h6,9-10H,5,7H2,1-4H3/b8-6+/t9-,10+/m1/s1
InChIKey UVEHLGSFDUHKJH-ZQMPTTJKSA-N
Molecular Weight 241.287 g/mol
SMILES C1(\C(C[C@@](O1)([C@]1(OC(C)(C)OC1)[H])[H])=C\N(C)C)=O
SPLASH splash10-0006-0090000000-1f79a569dd2d9836839f
Source of Spectrum F-45-6641-24
Synonyms (3E,5R)-5-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-[(dimethylamino)methylidene]oxolan-2-one (4S,5R)-2-(E)-N,N-dimethylaminomethylidene-4-[5,6-O-(1-methylethylidene)]-.gamma.-hexanolactone
Wiley ID 1244002