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No Name
SpectraBase Compound ID JfB2KPGIXYw
InChI InChI=1S/C13H18O3/c1-6(14)15-12-9-3-7-2-8(4-9)11-5-10(7)13(12)16-11/h7-13H,2-5H2,1H3/t7-,8+,9-,10-,11+,12?,13-/m1/s1
InChIKey XBQNOBWNVNUATK-LTPIREQTSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 93zUbELN0Ch
Name
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-6(14)15-12-9-3-7-2-8(4-9)11-5-10(7)13(12)16-11/h7-13H,2-5H2,1H3/t7-,8+,9-,10-,11+,12?,13-/m1/s1
InChIKey XBQNOBWNVNUATK-LTPIREQTSA-N
Molecular Weight 222.1251
SMILES [C@@]12(C[C@]3([C@]4(OC(C(C4)[C@](C3)(C1)[H])C2OC(C)=O)[H])[H])[H]
SPLASH splash10-01ox-9600000000-5d643853f72c6ab9b247
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany