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[10.3.3]Propellane
SpectraBase Compound ID ARsxEQ4XA2b
InChI InChI=1S/C18H32/c1-2-4-6-8-12-18-15-9-13-17(18,14-10-16-18)11-7-5-3-1/h1-16H2/t17-,18+
InChIKey XGSXVKONXFSHPS-HDICACEKSA-N
Mol Weight 248.5 g/mol
Molecular Formula C18H32
Exact Mass 248.250401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2XrsSVRP8K
Name [10.3.3]Propellane
CAS Registry Number 58602-52-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H32
InChI InChI=1S/C18H32/c1-2-4-6-8-12-18-15-9-13-17(18,14-10-16-18)11-7-5-3-1/h1-16H2/t17-,18+
InChIKey XGSXVKONXFSHPS-HDICACEKSA-N
Molecular Weight 248.454 g/mol
SMILES [C@]123[C@](CCC3)(CCC1)CCCCCCCCCC2
SPLASH splash10-00dj-0970000000-d10f26a32a77f2acc27d
Source of Spectrum J-41-1906-0
Synonyms Tricyclo[10.3.3.0(1,12)]octadecane
Wiley ID 1251840