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[(+-)-1.alpha.]-N-[[6-(Acetyloxy)-3-oxo-4-cyclocten-1-yl]methyl]acetamide
SpectraBase Compound ID 2zqlUoIoYJv
InChI InChI=1S/C13H19NO4/c1-9(15)14-8-11-3-5-13(18-10(2)16)6-4-12(17)7-11/h4,6,11,13H,3,5,7-8H2,1-2H3,(H,14,15)/b6-4-/t11-,13?/m0/s1
InChIKey BJJYLZQCFRJGEZ-BACDYUMKSA-N
Mol Weight 253.3 g/mol
Molecular Formula C13H19NO4
Exact Mass 253.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Pkl7F3D8Y5
Name [(+-)-1.alpha.]-N-[[6-(Acetyloxy)-3-oxo-4-cyclocten-1-yl]methyl]acetamide
CAS Registry Number 123836-36-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19NO4
InChI InChI=1S/C13H19NO4/c1-9(15)14-8-11-3-5-13(18-10(2)16)6-4-12(17)7-11/h4,6,11,13H,3,5,7-8H2,1-2H3,(H,14,15)/b6-4-/t11-,13?/m0/s1
InChIKey BJJYLZQCFRJGEZ-BACDYUMKSA-N
Molecular Weight 253.298 g/mol
SMILES N(C(=O)C)C[C@@]1(CC(\C=C/C(OC(=O)C)CC1)=O)[H]
SPLASH splash10-0006-9510000000-545f00d8d4725238d89f
Source of Spectrum C-112-332-18
Synonyms (6S)-6-[(acetylamino)methyl]-4-oxo-2-cycloocten-1-yl acetate
Wiley ID 1256731