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N-[(2R,4S,4aS,7R,8aR)-4,7-dimethyl-2-phenyl-2,3,4a,5,6,7,8,8a-octahydrochromen-4-yl]acetamide
SpectraBase Compound ID A9p4XTVRQ5u
InChI InChI=1S/C19H27NO2/c1-13-9-10-16-17(11-13)22-18(15-7-5-4-6-8-15)12-19(16,3)20-14(2)21/h4-8,13,16-18H,9-12H2,1-3H3,(H,20,21)/t13-,16-,17-,18-,19+/m1/s1
InChIKey HSVHDQYMHABCQR-PYJZQUQOSA-N
Mol Weight 301.43 g/mol
Molecular Formula C19H27NO2
Exact Mass 301.204179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ikcH2L8d0m
Name N-[(2R,4S,4aS,7R,8aR)-4,7-dimethyl-2-phenyl-2,3,4a,5,6,7,8,8a-octahydrochromen-4-yl]acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H27NO2
InChI InChI=1S/C19H27NO2/c1-13-9-10-16-17(11-13)22-18(15-7-5-4-6-8-15)12-19(16,3)20-14(2)21/h4-8,13,16-18H,9-12H2,1-3H3,(H,20,21)/t13-,16-,17-,18-,19+/m1/s1
InChIKey HSVHDQYMHABCQR-PYJZQUQOSA-N
Ionization Type EI
Literature Reference DOI 10.1002/cctc.202000070
Molecular Weight 301.430 g/mol
SMILES N([C@@]1([C@]2([C@@](C[C@@](CC2)(C)[H])(O[C@](C1)(c1ccccc1)[H])[H])[H])C)C(C)=O
SPLASH splash10-0a7j-7920000000-f3833e728dbfb4ebcafe
Source of Spectrum CCC-12-SM12-S-3
Wiley ID 1839898