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SXPTWBDKLVMRLI-MIJXAVMKSA-N
SpectraBase Compound ID 5m8Y6kyLswR
InChI InChI=1S/C14H22O/c1-13(2)7-4-8-14(3)10-6-5-9(11(10)13)12(14)15/h9-11H,4-8H2,1-3H3/t9-,10+,11-,14-/m0/s1
InChIKey SXPTWBDKLVMRLI-MIJXAVMKSA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DTHSPoucrvo
Name Longicamphenylone
CAS Registry Number 38647-26-6
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 206.167065327 u
Formula C14H22O
InChI InChI=1S/C14H22O/c1-13(2)7-4-8-14(3)10-6-5-9(11(10)13)12(14)15/h9-11H,4-8H2,1-3H3/t9-,10+,11-,14-/m0/s1
InChIKey SXPTWBDKLVMRLI-MIJXAVMKSA-N
Molecular Weight 206.329 g/mol
Number of Peaks 50
RI1 1560
SMILES [C@]12([C@]3(C(CCC[C@@]1(C([C@]3(CC2)[H])=O)C)(C)C)[H])[H]
SPLASH splash10-052f-9400000000-fdb43290f7642f22eb0a
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 1,4-Methanoazulen-9-one, decahydro-4,8,8-trimethyl-
Wiley ID LM_FFNSC3_2919