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2-.alpha.-Acetoxyamorpha-4,7(11)-dien-8-one
SpectraBase Compound ID DSDW1dCfhM9
InChI InChI=1S/C16H22O3/c1-9(2)16-13-7-10(3)8-15(19-11(4)17)12(13)5-6-14(16)18/h7,12-13,15H,5-6,8H2,1-4H3/t12-,13-,15?/m0/s1
InChIKey GIEAJSSTLOJNKY-QNIGDANOSA-N
Mol Weight 262.35 g/mol
Molecular Formula C16H22O3
Exact Mass 262.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 74ORoIKbdg9
Name Amorpha-4,7(11)-dien-8-one<2-alpha-acetoxy->
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 262.156894565 u
Formula C16H22O3
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness)
GC Oven Program 60 °C to 246 °C at 3 °C/min.
InChI InChI=1S/C16H22O3/c1-9(2)16-13-7-10(3)8-15(19-11(4)17)12(13)5-6-14(16)18/h7,12-13,15H,5-6,8H2,1-4H3/t12-,13-,15?/m0/s1
InChIKey GIEAJSSTLOJNKY-QNIGDANOSA-N
Molecular Weight 262.349 g/mol
Nominal Mass 262 u
Number of Peaks 159
SMILES CC(=O)OC1[C@@]2([C@](C=C(C1)C)(C(C(CC2)=O)=C(C)C)[H])[H]
SPLASH splash10-0f6x-7930000000-1509ae7848b0de7670cb
Source ex MARSUPELLA ex KOENIG
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA000055