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4-Homobrendane-3-carboxylic acid

View entire compound with spectra: 1 MS (GC)

4-Homobrendane-3-carboxylic acid
SpectraBase Compound ID Hxhr0ncXlkt
InChI InChI=1S/C11H16O2/c12-10(13)11-3-1-2-8-4-7(6-11)5-9(8)11/h7-9H,1-6H2,(H,12,13)/t7-,8+,9-,11+/m1/s1
InChIKey RYBGKGNPEUWDQA-LOKLDPHHSA-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 4QNDDNpHyLt
Name 4-Homobrendane-3-carboxylic acid
CAS Registry Number 66085-40-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O2
InChI InChI=1S/C11H16O2/c12-10(13)11-3-1-2-8-4-7(6-11)5-9(8)11/h7-9H,1-6H2,(H,12,13)/t7-,8+,9-,11+/m1/s1
InChIKey RYBGKGNPEUWDQA-LOKLDPHHSA-N
Molecular Weight 180.247 g/mol
SMILES OC([C@@]12[C@]3([C@](C[C@@](C2)(C3)[H])(CCC1)[H])[H])=O
SPLASH splash10-000i-2900000000-a782a802ad4eff6c1484
Source of Spectrum J-43-2611-0
Wiley ID 1176503