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10-(Isothiocyanato)-4,6-amorphadiene

View entire compound with spectra: 1 MS (GC)

10-(Isothiocyanato)-4,6-amorphadiene
SpectraBase Compound ID CXI8lkXbah5
InChI InChI=1S/C16H23NS/c1-11(2)13-7-8-16(4,18-10-17)15-6-5-12(3)9-14(13)15/h9,11,15H,5-8H2,1-4H3
InChIKey ASHYFCMHGTXDGX-UHFFFAOYSA-N
Mol Weight 261.43 g/mol
Molecular Formula C16H23NS
Exact Mass 261.155121 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K0xuD5n2osE
Name 10-(Isothiocyanato)-4,6-amorphadiene
Comments Removed - expert review: contamination (chloroform))
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23NS
InChI InChI=1S/C16H23NS/c1-11(2)13-7-8-16(4,18-10-17)15-6-5-12(3)9-14(13)15/h9,11,15H,5-8H2,1-4H3
InChIKey ASHYFCMHGTXDGX-UHFFFAOYSA-N
Molecular Weight 261.427 g/mol
SMILES C12=C(CCC(C2CCC(=C1)C)(SC#N)C)C(C)C
SPLASH splash10-001r-9000000000-95c5a6e406c38d719dae
Source of Spectrum X2-54-77-3
Wiley ID 1603868