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Methyl 11-chloro-12-hydroxypodocarpa-8,11,13-trien-19-oate
SpectraBase Compound ID 89oimLkcrWo
InChI InChI=1S/C18H23ClO3/c1-17-9-4-10-18(2,16(21)22-3)13(17)8-6-11-5-7-12(20)15(19)14(11)17/h5,7,13,20H,4,6,8-10H2,1-3H3/t13?,17-,18+/m0/s1
InChIKey LEGGSPRFMPHZPX-UGGKNOJYSA-N
Mol Weight 322.83 g/mol
Molecular Formula C18H23ClO3
Exact Mass 322.133572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BomnbuMtW8J
Name Methyl 11-chloro-12-hydroxypodocarpa-8,11,13-trien-19-oate
Alternate Name(s) Methyl (4beta)-11-chloro-12-hydroxypodocarpa-8,11,13-trien-15-oate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23ClO3
InChI InChI=1S/C18H23ClO3/c1-17-9-4-10-18(2,16(21)22-3)13(17)8-6-11-5-7-12(20)15(19)14(11)17/h5,7,13,20H,4,6,8-10H2,1-3H3/t13?,17-,18+/m0/s1
InChIKey LEGGSPRFMPHZPX-UGGKNOJYSA-N
Molecular Weight 322.832 g/mol
SMILES Oc1c(c2[C@@]3(C([C@@](C(=O)OC)(C)CCC3)CCc2cc1)C)Cl
SPLASH splash10-006w-0497000000-8594f270c8d6df6ef1f2
Source of Spectrum B-51-42-18
Wiley ID 746007