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Bicyclo[3.3.1]hept-3-ene, 4,6,6-trimethyl-2-vinyloxy-

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

Bicyclo[3.3.1]hept-3-ene, 4,6,6-trimethyl-2-vinyloxy-
SpectraBase Compound ID 1YuibY9Kbfa
InChI InChI=1S/C12H18O/c1-5-13-11-6-8(2)9-7-10(11)12(9,3)4/h5-6,9-11H,1,7H2,2-4H3/t9-,10+,11?/m1/s1
InChIKey PETLFMRRUIPVGW-JKIOLJMWSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID J8nF8zAG6sr
Name Bicyclo[3.3.1]hept-3-ene, 4,6,6-trimethyl-2-vinyloxy-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 178.135765199 u
Formula C12H18O
InChI InChI=1S/C12H18O/c1-5-13-11-6-8(2)9-7-10(11)12(9,3)4/h5-6,9-11H,1,7H2,2-4H3/t9-,10+,11?/m1/s1
InChIKey PETLFMRRUIPVGW-JKIOLJMWSA-N
Molecular Weight 178.275 g/mol
SMILES [C@]12(C(C)=CC([C@](C2)(C1(C)C)[H])OC=C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.953283