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TIMDA-adduct

View entire compound with spectra: 1 MS (GC)

TIMDA-adduct
SpectraBase Compound ID ACUOUZ7mRU6
InChI InChI=1S/C16H20O/c17-15-11-7-9-13-5-1-3-12-4-2-6-14(10-8-11)16(12,13)15/h1-2,5-6,11-14H,3-4,7-10H2
InChIKey CXFSTJCYDKKTFO-UHFFFAOYSA-N
Mol Weight 228.33 g/mol
Molecular Formula C16H20O
Exact Mass 228.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BhCRAZup4J5
Name TIMDA-adduct
Alternate Name(s) 15-Oxotetracyclohexadeca-4,9-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O
InChI InChI=1S/C16H20O/c17-15-11-7-9-13-5-1-3-12-4-2-6-14(10-8-11)16(12,13)15/h1-2,5-6,11-14H,3-4,7-10H2
InChIKey CXFSTJCYDKKTFO-UHFFFAOYSA-N
Molecular Weight 228.335 g/mol
SMILES C123C(C4CCC3C=CCC1CC=CC2CC4)=O
SPLASH splash10-054p-6920000000-dc0c8d323f591fa0db73
Source of Spectrum SK-25-530-4
Wiley ID 866516