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3-[(2,4-diacetoxy-3,3-dimethyl-butanoyl)amino]propyl acetate
SpectraBase Compound ID L1p4BiOpD2w
InChI InChI=1S/C15H25NO7/c1-10(17)21-8-6-7-16-14(20)13(23-12(3)19)15(4,5)9-22-11(2)18/h13H,6-9H2,1-5H3,(H,16,20)
InChIKey IFYVAPPYWOMVDP-UHFFFAOYSA-N
Mol Weight 331.37 g/mol
Molecular Formula C15H25NO7
Exact Mass 331.163102 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3noXtBLSLI
Name Panthenol 3AC
Classification Dermatic
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Exact Mass 331.163102142 u
Formula C15H25NO7
InChI InChI=1S/C15H25NO7/c1-10(17)21-8-6-7-16-14(20)13(23-12(3)19)15(4,5)9-22-11(2)18/h13H,6-9H2,1-5H3,(H,16,20)
InChIKey IFYVAPPYWOMVDP-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 331.365 g/mol
SMILES CC(OCC(C)(C)C(C(NCCCOC(=O)C)=O)OC(=O)C)=O
SPLASH splash10-014i-6920000000-7412ced86a0aa8967203
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Sample Preparation Procedure Detected: U+UHYAC
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_1509