Bicyclo[4.3.1]deca-2,4,7-triene, 2,5,9-trimethyl-, exo-

SpectraBase Compound ID	8Lii6pqU3OM
InChI	InChI=1S/C13H18/c1-9-4-5-10(2)13-8-12(9)7-6-11(13)3/h4-7,11-13H,8H2,1-3H3
InChIKey	HWJXVPSFEYAAQO-UHFFFAOYSA-N Google Search
Mol Weight	174.29 g/mol
Molecular Formula	C13H18
Exact Mass	174.140851 g/mol

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SpectraBase Spectrum ID	SGfeCTV3mG
Name	Bicyclo[4.3.1]deca-2,4,7-triene, 2,5,9-trimethyl-, exo-
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	174.140850580 u
Formula	C13H18
InChI	InChI=1S/C13H18/c1-9-4-5-10(2)13-8-12(9)7-6-11(13)3/h4-7,11-13H,8H2,1-3H3
InChIKey	HWJXVPSFEYAAQO-UHFFFAOYSA-N
Molecular Weight	174.287 g/mol
SMILES	C12CC(C(C)=CC=C2C)C=CC1C
Spectrum/Structure Validation Score (Vapor Phase IR)	0.937647