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1-Adamantanecarboxylic acid, 2-methoxy-4-chlorophenyl ester
SpectraBase Compound ID IT4BxDr70C9
InChI InChI=1S/C18H21ClO3/c1-21-16-7-14(19)2-3-15(16)22-17(20)18-8-11-4-12(9-18)6-13(5-11)10-18/h2-3,7,11-13H,4-6,8-10H2,1H3/t11-,12+,13-,18-
InChIKey QPGSANAUSIXSCO-MCXHQAMOSA-N
Mol Weight 320.82 g/mol
Molecular Formula C18H21ClO3
Exact Mass 320.117922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G5W5BRO79cy
Name 1-Adamantanecarboxylic acid, 2-methoxy-4-chlorophenyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21ClO3
InChI InChI=1S/C18H21ClO3/c1-21-16-7-14(19)2-3-15(16)22-17(20)18-8-11-4-12(9-18)6-13(5-11)10-18/h2-3,7,11-13H,4-6,8-10H2,1H3/t11-,12+,13-,18-
InChIKey QPGSANAUSIXSCO-MCXHQAMOSA-N
Molecular Weight 320.816 g/mol
SMILES C12(C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])C(Oc1ccc(cc1OC)Cl)=O
SPLASH splash10-000i-4900000000-23acb1eb0d49558be36b
Source of Spectrum TIPS-2023-111-0
Wiley ID 1884819