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1,1-Dibutylisochroman

View entire compound with spectra: 1 MS (GC)

1,1-Dibutylisochroman
SpectraBase Compound ID 37h6bRx6OL7
InChI InChI=1S/C17H26O/c1-3-5-12-17(13-6-4-2)16-10-8-7-9-15(16)11-14-18-17/h7-10H,3-6,11-14H2,1-2H3
InChIKey URSMMGJGMQCXJI-UHFFFAOYSA-N
Mol Weight 246.39 g/mol
Molecular Formula C17H26O
Exact Mass 246.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 44GBSOVdG5d
Name 1,1-Dibutylisochroman
Alternate Name(s) 1,1-Dibutylisochromane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26O
InChI InChI=1S/C17H26O/c1-3-5-12-17(13-6-4-2)16-10-8-7-9-15(16)11-14-18-17/h7-10H,3-6,11-14H2,1-2H3
InChIKey URSMMGJGMQCXJI-UHFFFAOYSA-N
Molecular Weight 246.394 g/mol
SMILES c1cc2c(cc1)C(OCC2)(CCCC)CCCC
SPLASH splash10-000i-0900000000-8f1f854a7db262d2b848
Source of Spectrum J-80-8110-19
Wiley ID 1801587