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Cryptomerione
SpectraBase Compound ID LwkCQjrXjnw
InChI InChI=1S/C15H22O/c1-11(2)6-5-7-12(3)14-9-8-13(4)15(16)10-14/h6,8,14H,3,5,7,9-10H2,1-2,4H3/t14-/m1/s1
InChIKey FNSXIWZZZIJORF-CQSZACIVSA-N
Mol Weight 218.34 g/mol
Molecular Formula C15H22O
Exact Mass 218.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5O2BgsaxhqR
Name Cryptomerione
CAS Registry Number 5988-72-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O
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/C15H22O/c1-11(2)6-5-7-12(3)14-9-8-13(4)15(16)10-14/h6,8,14H,3,5,7,9-10H2,1-2,4H3/t14-/m1/s1
InChIKey FNSXIWZZZIJORF-CQSZACIVSA-N
Molecular Weight 218.340 g/mol
SMILES C1(C(=CC[C@](C1)(C(CCC=C(C)C)=C)[H])C)=O
SPLASH splash10-05mo-9600000000-48a91fe35a503a4eee5d
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1887263