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Isobornyl isobutanoate <8-isobutyryloxy->
SpectraBase Compound ID 15DnIxbT8zq
InChI InChI=1S/C18H30O4/c1-11(2)15(19)21-10-18(6)13-7-8-17(18,5)14(9-13)22-16(20)12(3)4/h11-14H,7-10H2,1-6H3/t13-,14-,17+,18+/m1/s1
InChIKey TYRVJKXVESQUNB-KNCCTNLNSA-N
Mol Weight 310.43 g/mol
Molecular Formula C18H30O4
Exact Mass 310.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FhGB9mQNb60
Name Isobornyl isobutanoate<8-isobutyryloxy->
CAS Registry Number 107783-35-7
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 310.214409442 u
Formula C18H30O4
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness)
GC Oven Program 60 °C to 246 °C at 3 °C/min.
InChI InChI=1S/C18H30O4/c1-11(2)15(19)21-10-18(6)13-7-8-17(18,5)14(9-13)22-16(20)12(3)4/h11-14H,7-10H2,1-6H3/t13-,14-,17+,18+/m1/s1
InChIKey TYRVJKXVESQUNB-KNCCTNLNSA-N
Molecular Weight 310.434 g/mol
Nominal Mass 310 u
Number of Peaks 156
SMILES [C@@]1(C[C@]2(CC[C@@]1([C@]2(COC(C(C)C)=O)C)C)[H])(OC(C(C)C)=O)[H]
SPLASH splash10-052f-9600000000-5a823738593ef479108e
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA000739