12-deuteriodispiro[4.0.56.15]dodeca-1,3,8-triene

SpectraBase Compound ID	4UXCA5epCTv
InChI	InChI=1S/C12H14/c1-2-6-11(7-3-1)10-12(11)8-4-5-9-12/h1-2,4-5,8-9H,3,6-7,10H2/i10D
InChIKey	LROBGWXEGGFUBK-MMIHMFRQSA-N Google Search
Mol Weight	159.25 g/mol
Molecular Formula	C12H13D
Exact Mass	159.115827 g/mol

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SpectraBase Spectrum ID	ftLCKLJ7g
Name	12-deuteriodispiro[4.0.56.15]dodeca-1,3,8-triene
Carrier Gas	Hydrogen (0.50 bar)
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	159.115827197 u
Formula	C12H13D
GC Column	DB-1 (30.0 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program	Oven temp 320oC
InChI	InChI=1S/C12H14/c1-2-6-11(7-3-1)10-12(11)8-4-5-9-12/h1-2,4-5,8-9H,3,6-7,10H2/i10D
InChIKey	LROBGWXEGGFUBK-MMIHMFRQSA-N
Instrument Name	Finnigan MAT SSQ 7000-Thermo Scientific Trace GC Ultra
Ionization Type	EI
Literature Reference DOI	10.1002/anie.202303119
Molecular Weight	159.250 g/mol
Quality	59
SMILES	C=1CC2(CCC1)C1(C2[D])C=CC=C1
SPLASH	splash10-001i-9200000000-b7a77f2d347b282b4c62
Source of Spectrum	ACI-62-SM17-6c-d1 (DOI: 10.1002/anie.202303119)
Wiley ID	1911185