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N-(2-(Benzo[d][1,3]dioxol-5-yl)ethyl)pentanamide
SpectraBase Compound ID CCFPbwptFlB
InChI InChI=1S/C14H19NO3/c1-2-3-4-14(16)15-8-7-11-5-6-12-13(9-11)18-10-17-12/h5-6,9H,2-4,7-8,10H2,1H3,(H,15,16)
InChIKey FYMPDRGNSPHBJL-UHFFFAOYSA-N
Mol Weight 249.31 g/mol
Molecular Formula C14H19NO3
Exact Mass 249.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3gWK2TcBykS
Name N-(2-(Benzo[d][1,3]dioxol-5-yl)ethyl)pentanamide
Appearance White solid
Carrier Gas Argon
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Exact Mass 249.136493473 u
Formula C14H19NO3
InChI InChI=1S/C14H19NO3/c1-2-3-4-14(16)15-8-7-11-5-6-12-13(9-11)18-10-17-12/h5-6,9H,2-4,7-8,10H2,1H3,(H,15,16)
InChIKey FYMPDRGNSPHBJL-UHFFFAOYSA-N
Instrument Name AMD 402
Ionization Type EI
Literature Reference DOI 10.1002/anie.202200062
Molecular Weight 249.310 g/mol
Quality 171
Reported Formula C14H19NO3
SMILES N(C(CCCC)=O)CCC1=CC=C2C(=C1)OCO2
SPLASH splash10-052r-9100000000-0f0238a4d795d8ae0901
Source of Spectrum ACI-61-SM44-6aj (DOI: 10.1002/anie.202200062)
Thin-Layer Chromatography 0.1 (pentane/EA, 5:1)
Wiley ID 1897624