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Pulicanadienal B

View entire compound with spectra: 1 MS (GC)

Pulicanadienal B
SpectraBase Compound ID JbR8nCC4h1z
InChI InChI=1S/C17H26O4/c1-12(2)15-7-9-17(4,20)8-5-6-14(11-18)10-16(15)21-13(3)19/h6-7,9,11-12,15-16,20H,5,8,10H2,1-4H3/b9-7-,14-6+
InChIKey LJPDGWZMSFNUPH-RBCNSMNFSA-N
Mol Weight 294.39 g/mol
Molecular Formula C17H26O4
Exact Mass 294.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8hbPr05zfpV
Name Pulicanadienal B
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26O4
InChI InChI=1S/C17H26O4/c1-12(2)15-7-9-17(4,20)8-5-6-14(11-18)10-16(15)21-13(3)19/h6-7,9,11-12,15-16,20H,5,8,10H2,1-4H3/b9-7-,14-6+
InChIKey LJPDGWZMSFNUPH-RBCNSMNFSA-N
Molecular Weight 294.391 g/mol
SMILES OC1(CC\C=C/(CC(C(\C=C/1)C(C)C)OC(=O)C)C=O)C
SPLASH splash10-0a4i-9000000000-379bc06682ff33e5b89b
Source of Spectrum X2-68-530-10
Synonyms 4-Methyl-7-isopropyl-10-formyl-8-acetoxy-4-hydroxycyclodeca-1(10),5-diene 9-formyl-5-hydroxy-2-isopropyl-5-methyl-3,8-cyclodecadien-1-yl acetate
Wiley ID 1609495