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1-Adamantanecarboxylic acid
SpectraBase Compound ID DRY2nCev0QV
InChI InChI=1S/C11H16O2/c12-10(13)11-4-7-1-8(5-11)3-9(2-7)6-11/h7-9H,1-6H2,(H,12,13)/t7-,8+,9-,11-
InChIKey JIMXXGFJRDUSRO-KJZNFTALSA-N
Mol Weight 180.25 g/mol
Molecular Formula C11H16O2
Exact Mass 180.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JB6c49FqmqM
Name 1-Adamantanecarboxylic acid
Comments MONAID: JP011066
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O2
InChI InChI=1S/C11H16O2/c12-10(13)11-4-7-1-8(5-11)3-9(2-7)6-11/h7-9H,1-6H2,(H,12,13)/t7-,8+,9-,11-
InChIKey JIMXXGFJRDUSRO-KJZNFTALSA-N
Ionization Type EI-B
Molecular Weight 180.247 g/mol
SMILES OC(=O)C12C[C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H]
SPLASH splash10-000i-6900000000-dcf49083c80afbbe69ad
Source of Spectrum SRH-2022-11066-0
Wiley ID 1832673