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cis-2,3a,8a-Trimethyl-3-methylene-3,3a,6,7,8,8a-hexahydroazulen-4(5H)-one
SpectraBase Compound ID IpJdmP1Gciy
InChI InChI=1S/C14H20O/c1-10-9-13(3)8-6-5-7-12(15)14(13,4)11(10)2/h9H,2,5-8H2,1,3-4H3/t13-,14-/m1/s1
InChIKey NCLKIHJVPVVZDZ-ZIAGYGMSSA-N
Mol Weight 204.31 g/mol
Molecular Formula C14H20O
Exact Mass 204.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 59cIjhMEJqA
Name cis-2,3a,8a-Trimethyl-3-methylene-3,3a,6,7,8,8a-hexahydroazulen-4(5H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O
InChI InChI=1S/C14H20O/c1-10-9-13(3)8-6-5-7-12(15)14(13,4)11(10)2/h9H,2,5-8H2,1,3-4H3/t13-,14-/m1/s1
InChIKey NCLKIHJVPVVZDZ-ZIAGYGMSSA-N
Literature Reference DOI 10.1021/acs.orglett.5b00348
Molecular Weight 204.313 g/mol
SMILES C=1(C(=C)[C@]2([C@@](C1)(CCCCC2=O)C)C)C
SPLASH splash10-0900-2910000000-e2a6bcd1b563f06efeac
Source of Spectrum A1-17-1465/SM34-13f
Synonyms (3aR,8aR)-2,3a,8a-trimethyl-3-methylene-3a,5,6,7,8,8a-hexahydroazulen-4(3H)-one
Wiley ID 1805041