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Bornyl salicylate
SpectraBase Compound ID LbG0AY6NQAO
InChI InChI=1S/C17H22O3/c1-16(2)11-8-9-17(16,3)14(10-11)20-15(19)12-6-4-5-7-13(12)18/h4-7,11,14,18H,8-10H2,1-3H3/t11-,14-,17+/m0/s1
InChIKey GAZVSNAEUUUDEK-UHFFFAOYSA-N
Mol Weight 274.36 g/mol
Molecular Formula C17H22O3
Exact Mass 274.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AZ9X3egzDMF
Name Bornyl salicylate
CAS Registry Number 560-88-3
Classification Rubefacient
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Exact Mass 274.156894565 u
Formula C17H22O3
InChI InChI=1S/C17H22O3/c1-16(2)11-8-9-17(16,3)14(10-11)20-15(19)12-6-4-5-7-13(12)18/h4-7,11,14,18H,8-10H2,1-3H3
InChIKey GAZVSNAEUUUDEK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 274.360 g/mol
SMILES C1CC2CC(OC(c3c(cccc3)O)=O)C1(C)C2(C)C
SPLASH splash10-008i-9500000000-1ddf6ed73aad90ef15be
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_1403