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(2S)-2-[(1R,4R,4aS,8aS)-4,7-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalen-1-yl]propanal

View entire compound with spectra: 3 MS (GC)

(2S)-2-[(1R,4R,4aS,8aS)-4,7-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalen-1-yl]propanal
SpectraBase Compound ID SFNaP7w0d4
InChI InChI=1S/C15H24O/c1-10-4-6-13-11(2)5-7-14(12(3)9-16)15(13)8-10/h8-9,11-15H,4-7H2,1-3H3/t11-,12-,13+,14+,15+/m1/s1
InChIKey PIUSZJFEZXYOAT-MRLBHPIUSA-N
Mol Weight 220.36 g/mol
Molecular Formula C15H24O
Exact Mass 220.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7xnPAuxOYw6
Name (2S)-2-[(1R,4R,4aS,8aS)-4,7-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalen-1-yl]propanal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 220.182715392 u
Formula C15H24O
InChI InChI=1S/C15H24O/c1-10-4-6-13-11(2)5-7-14(12(3)9-16)15(13)8-10/h8-9,11-15H,4-7H2,1-3H3/t11-,12-,13+,14+,15+/m1/s1
InChIKey PIUSZJFEZXYOAT-MRLBHPIUSA-N
Instrument Name Hewlett Packard 6890 GC
Ionization Type EI
Literature Reference DOI 10.1002/anie.201609557
Molecular Weight 220.356 g/mol
Quality 813
SMILES C1[C@]([C@]2([C@@]([C@@](C1)([C@@](C=O)(C)[H])[H])(C=C(CC2)C)[H])[H])(C)[H]
SPLASH splash10-0ikj-1910000000-60ec7a050ff59df8c541
Source of Spectrum ACI-56-SM27-(11S)-4 (DOI: 10.1002/anie.201609557)
Wiley ID 1895584