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PHENANTHRENE, 7-ETHENYL-1,2,3,4,4A,4B,5,6,7,8,8A,9-DODECAHYDRO-1,1,4B,
SpectraBase Compound ID G3al5htsksU
InChI InChI=1S/C20H32/c1-6-19(4)12-13-20(5)15(14-19)9-10-16-17(20)8-7-11-18(16,2)3/h6,10,15,17H,1,7-9,11-14H2,2-5H3/t15-,17-,19+,20-/m1/s1
InChIKey BAIWMJSLFJWAQP-WSTLGDPDSA-N
Mol Weight 272.5 g/mol
Molecular Formula C20H32
Exact Mass 272.250401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7dtAsk2R9SZ
Name Rimuene
CAS Registry Number 1686-67-5
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 272.250401030 u
Formula C20H32
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/C20H32/c1-6-19(4)12-13-20(5)15(14-19)9-10-16-17(20)8-7-11-18(16,2)3/h6,10,15,17H,1,7-9,11-14H2,2-5H3/t15-,17-,19+,20-/m1/s1
InChIKey BAIWMJSLFJWAQP-WSTLGDPDSA-N
Molecular Weight 272.476 g/mol
Nominal Mass 272 u
Number of Peaks 203
SMILES C[C@@]12[C@]3(C(=CC[C@@]2(C[C@](CC1)(C=C)C)[H])C(C)(C)CCC3)[H]
SPLASH splash10-0a4i-8960000000-565fc2d91adea9eac64a
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA001192