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Ferula lactone I
SpectraBase Compound ID GiEAM568auP
InChI InChI=1S/C15H18O2/c1-8-4-7-12-10(3)15(16)17-14(12)13-9(2)5-6-11(8)13/h5,11,13-14H,1,4,6-7H2,2-3H3/t11-,13-,14-/m0/s1
InChIKey WAQFXLYLGJEYAW-UBHSHLNASA-N
Mol Weight 230.31 g/mol
Molecular Formula C15H18O2
Exact Mass 230.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H0bQkUzklDm
Name Ferula lactone I
CAS Registry Number 159143-07-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O2
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C15H18O2/c1-8-4-7-12-10(3)15(16)17-14(12)13-9(2)5-6-11(8)13/h5,11,13-14H,1,4,6-7H2,2-3H3/t11-,13-,14-/m0/s1
InChIKey WAQFXLYLGJEYAW-UBHSHLNASA-N
Molecular Weight 230.307 g/mol
SMILES C1=C([C@@]2([C@@]3(C(CCC([C@@]2(C1)[H])=C)=C(C(O3)=O)C)[H])[H])C
SPLASH splash10-0kdl-9710000000-1ecc848a60ebbc741250
Source ex FERULA ARIGONII ex JOSEPH CASANOVA
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1886356