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3-Carbomethoxy-6-isopropyl-1-oxa-3,3a,4,5,6,7,8,8a-octahydroazulen-2(1h)-one
SpectraBase Compound ID AuHYakQWF8E
InChI InChI=1S/C14H22O4/c1-8(2)9-4-6-10-11(7-5-9)18-14(16)12(10)13(15)17-3/h8-12H,4-7H2,1-3H3
InChIKey BTBGIRSEZXWHEE-UHFFFAOYSA-N
Mol Weight 254.33 g/mol
Molecular Formula C14H22O4
Exact Mass 254.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BpjLOAAyiYe
Name 3-Carbomethoxy-6-isopropyl-1-oxa-3,3a,4,5,6,7,8,8a-octahydroazulen-2(1h)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O4
InChI InChI=1S/C14H22O4/c1-8(2)9-4-6-10-11(7-5-9)18-14(16)12(10)13(15)17-3/h8-12H,4-7H2,1-3H3
InChIKey BTBGIRSEZXWHEE-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 254.326 g/mol
SMILES COC(=O)C1C(=O)OC2C1CCC(CC2)C(C)C
SPLASH splash10-0f7x-7910000000-d434f7f331a5d21ebe1b
Source of Spectrum SRH-2022-11369-0
Wiley ID 1832962