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Cedryl methyl ketone
SpectraBase Compound ID DsmroClBe9E
InChI InChI=1S/C17H26O/c1-10-6-7-15-16(4,5)14-9-17(10,15)8-13(11(14)2)12(3)18/h10,14-15H,6-9H2,1-5H3/t10-,14+,15+,17+/m1/s1
InChIKey YBUIAJZFOGJGLJ-SWRJLBSHSA-N
Mol Weight 246.39 g/mol
Molecular Formula C17H26O
Exact Mass 246.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7nRnQSi1kvg
Name Cedryl methyl ketone
CAS Registry Number 68039-35-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26O
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/C17H26O/c1-10-6-7-15-16(4,5)14-9-17(10,15)8-13(11(14)2)12(3)18/h10,14-15H,6-9H2,1-5H3/t10-,14+,15+,17+/m1/s1
InChIKey YBUIAJZFOGJGLJ-SWRJLBSHSA-N
Molecular Weight 246.394 g/mol
SMILES [C@]12([H])C([C@]3(C[C@]1([C@](C)(CC2)[H])CC(=C3C)C(=O)C)[H])(C)C
SPLASH splash10-0006-9610000000-5948f6e313c060c57ffc
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1886077