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4-Methylpentyl 1-adamantanecarboxylate
SpectraBase Compound ID GCiZTp6oNK2
InChI InChI=1S/C17H28O2/c1-12(2)4-3-5-19-16(18)17-9-13-6-14(10-17)8-15(7-13)11-17/h12-15H,3-11H2,1-2H3/t13-,14+,15-,17-
InChIKey ZUULBHXFYFYKQO-LTBQPASTSA-N
Mol Weight 264.41 g/mol
Molecular Formula C17H28O2
Exact Mass 264.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JT9z3PSMXHt
Name 4-Methylpentyl 1-adamantanecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H28O2
InChI InChI=1S/C17H28O2/c1-12(2)4-3-5-19-16(18)17-9-13-6-14(10-17)8-15(7-13)11-17/h12-15H,3-11H2,1-2H3/t13-,14+,15-,17-
InChIKey ZUULBHXFYFYKQO-LTBQPASTSA-N
Molecular Weight 264.409 g/mol
SMILES C(COC(C12C[C@]3(C[C@@](C2)(C[C@](C3)(C1)[H])[H])[H])=O)CC(C)C
SPLASH splash10-001r-6900000000-0a0251411946e573e6e7
Source of Spectrum NP-7-9679-0
Synonyms 1-Adamantanecarboxylic acid, 4-methylpentyl ester 1-Adamantanecarboxylic acid 4-methylpentyl ester isohexyl adamantane-1-carboxylate 4-Methylpentyl adamantane-1-carboxylate
Wiley ID 1106969