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2,5,6,7,8,9,10,11,12,13,14,14a-dodecahydro-1H-benzocyclododecen-3-one
SpectraBase Compound ID HOgQruaC9aX
InChI InChI=1S/C16H26O/c17-16-12-11-14-9-7-5-3-1-2-4-6-8-10-15(14)13-16/h13-14H,1-12H2
InChIKey OBRHPKKTTCLTFD-UHFFFAOYSA-N
Mol Weight 234.38 g/mol
Molecular Formula C16H26O
Exact Mass 234.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9mCZ7gozcBl
Name 2,5,6,7,8,9,10,11,12,13,14,14a-dodecahydro-1H-benzocyclododecen-3-one
CAS Registry Number 40050-37-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O
InChI InChI=1S/C16H26O/c17-16-12-11-14-9-7-5-3-1-2-4-6-8-10-15(14)13-16/h13-14H,1-12H2
InChIKey OBRHPKKTTCLTFD-UHFFFAOYSA-N
Molecular Weight 234.383 g/mol
SMILES C1(=O)C=C2C(CCCCCCCCCC2)CC1
SPLASH splash10-01po-5940000000-7db7e8c3a62706f3c4b4
Source of Spectrum KC-1977-264-0
Synonyms 2,5,6,7,8,9,10,11,12,13,14,14a-dodecahydro-1H-benzo[12]annulen-3-one
Wiley ID 1236636