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.beta.-Costol
SpectraBase Compound ID 4VrHCdUdb74
InChI InChI=1S/C15H24O/c1-11-5-4-7-15(3)8-6-13(9-14(11)15)12(2)10-16/h13-14,16H,1-2,4-10H2,3H3/t13-,14+,15-/m1/s1
InChIKey FKWGZOFNSIESOX-QLFBSQMISA-N
Mol Weight 220.36 g/mol
Molecular Formula C15H24O
Exact Mass 220.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EijpX90tSNR
Name Costol
CAS Registry Number 515-20-8
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 220.182715392 u
Formula C15H24O
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/C15H24O/c1-11-5-4-7-15(3)8-6-13(9-14(11)15)12(2)10-16/h13-14,16H,1-2,4-10H2,3H3/t13-,14+,15-/m1/s1
InChIKey FKWGZOFNSIESOX-QLFBSQMISA-N
Molecular Weight 220.356 g/mol
Nominal Mass 220 u
Number of Peaks 122
SMILES OCC([C@]1(C[C@@]2([C@@](CCCC2=C)(C)CC1)[H])[H])=C
SPLASH splash10-052f-9700000000-1b115307f95ac64659c5
Source ex COSTUS ROOT OIL
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA000366