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1-Adamantanol 4-formylbenzoate
SpectraBase Compound ID DuGIPoeJ2u
InChI InChI=1S/C18H20O3/c19-11-12-1-3-16(4-2-12)17(20)21-18-8-13-5-14(9-18)7-15(6-13)10-18/h1-4,11,13-15H,5-10H2/t13-,14+,15-,18-
InChIKey ARVKSVHIEGLNNT-OVMOHIIOSA-N
Mol Weight 284.36 g/mol
Molecular Formula C18H20O3
Exact Mass 284.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 70rAW20IF0G
Name 1-Adamantanol 4-formylbenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O3
InChI InChI=1S/C18H20O3/c19-11-12-1-3-16(4-2-12)17(20)21-18-8-13-5-14(9-18)7-15(6-13)10-18/h1-4,11,13-15H,5-10H2/t13-,14+,15-,18-
InChIKey ARVKSVHIEGLNNT-OVMOHIIOSA-N
Literature Reference DOI 10.1039/C4RA14586K
Molecular Weight 284.355 g/mol
SMILES [C@]12(C[C@@]3(C[C@](C2)(CC(C1)(C3)OC(=O)c1ccc(cc1)C=O)[H])[H])[H]
SPLASH splash10-001l-5910000000-05347f5f775450c15b9c
Source of Spectrum RSA-5-7232/SM5-3j
Synonyms (3s,5s,7s)-adamantan-1-yl 4-formylbenzoate
Wiley ID 1805505