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SANTEN
SpectraBase Compound ID L8X5qT5PqOw
InChI InChI=1S/C9H14/c1-6-7(2)9-4-3-8(6)5-9/h8-9H,3-5H2,1-2H3/t8-,9+
InChIKey LSIXBBPOJBJQHN-DTORHVGOSA-N
Mol Weight 122.21 g/mol
Molecular Formula C9H14
Exact Mass 122.10955 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1vcO9ic4b6t
Name Santene
Source of Sample SAFC Cat.no. W300500
CAS Registry Number 529-16-8
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 122.109550451 u
Formula C9H14
InChI InChI=1S/C9H14/c1-6-7(2)9-4-3-8(6)5-9/h8-9H,3-5H2,1-2H3/t8-,9+
InChIKey LSIXBBPOJBJQHN-DTORHVGOSA-N
Molecular Weight 122.211 g/mol
Number of Peaks 46
RI1 880
RI2 544
SMILES C1[C@]2(C(=C([C@@](C1)(C2)[H])C)C)[H]
SPLASH splash10-002f-9100000000-2c1941d7df07844d5766
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 Bicyclo[2.2.1]hept-2-ene, 2,3-dimethyl-
Wiley ID LM_FFNSC3_446