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Isopentyl 1-adamantanecarboxylate
SpectraBase Compound ID CxtDUaUc0yM
InChI InChI=1S/C16H26O2/c1-11(2)3-4-18-15(17)16-8-12-5-13(9-16)7-14(6-12)10-16/h11-14H,3-10H2,1-2H3/t12-,13+,14-,16-
InChIKey SIWLSHFXCFPRTF-UHFFFAOYSA-N
Mol Weight 250.38 g/mol
Molecular Formula C16H26O2
Exact Mass 250.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GLJ1kMbUXbu
Name Isopentyl 1-adamantanecarboxylate
CAS Registry Number 73956-36-2
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O2
InChI InChI=1S/C16H26O2/c1-11(2)3-4-18-15(17)16-8-12-5-13(9-16)7-14(6-12)10-16/h11-14H,3-10H2,1-2H3/t12-,13+,14-,16-
InChIKey SIWLSHFXCFPRTF-UHFFFAOYSA-N
Molecular Weight 250.382 g/mol
SMILES C1[C@]2(C[C@]3(CC1(C(=O)OCCC(C)C)C[C@@](C2)(C3)[H])[H])[H]
SPLASH splash10-0019-3900000000-d5675189f359f0881981
Source of Spectrum NP-7-1290-0
Synonyms 1-Adamantanecarboxylic acid, 3-methylbutyl ester 1-Adamantanecarboxylic acid 3-methylbutyl ester isopentyl adamantane-1-carboxylate 3-Methylbutyl adamantane-1-carboxylate
Wiley ID 1106307