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2a-chloro-8,13-epoxylabd-14-ene
SpectraBase Compound ID HxGW5vE4KjB
InChI InChI=1S/C20H33ClO/c1-7-18(4)10-8-16-19(5)13-14(21)12-17(2,3)15(19)9-11-20(16,6)22-18/h7,14-16H,1,8-13H2,2-6H3/t14-,15-,16+,18-,19-,20+/m0/s1
InChIKey XNWQUOSYSHXMLL-JFVPRCSHSA-N
Mol Weight 324.9 g/mol
Molecular Formula C20H33ClO
Exact Mass 324.221993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5sSF5VozRwp
Name 2a-chloro-8,13-epoxylabd-14-ene
Alternate Name(s) (3R,4aR,6aS,9S,10aS,10bR)-9-chloro-3,4a,7,7,10a-pentamethyl-3-vinyldodecahydro-1H-benzo[f]chromene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H33ClO
InChI InChI=1S/C20H33ClO/c1-7-18(4)10-8-16-19(5)13-14(21)12-17(2,3)15(19)9-11-20(16,6)22-18/h7,14-16H,1,8-13H2,2-6H3/t14-,15-,16+,18-,19-,20+/m0/s1
InChIKey XNWQUOSYSHXMLL-JFVPRCSHSA-N
Molecular Weight 324.936 g/mol
SMILES [C@]12([C@@]3([C@@](O[C@](CC3)(C=C)C)(C)CC[C@]1(C(C)(C)C[C@@](C2)(Cl)[H])[H])[H])C
SPLASH splash10-00fr-0009000000-50ce6d0bebaadff4f891
Source of Spectrum B-46-1125-0
Wiley ID 1323550