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Spiro[2H-1-benzopyran-2,2'(5'H)-furan]-4(3H)-one, 3',5'-dimethyl-, trans-(.+-.)-
SpectraBase Compound ID 6w8WEibda0e
InChI InChI=1S/C14H14O3/c1-9-7-10(2)16-14(9)8-12(15)11-5-3-4-6-13(11)17-14/h3-7,10H,8H2,1-2H3/t10-,14-/m0/s1
InChIKey MLACTXCGUUXTOT-HZMBPMFUSA-N
Mol Weight 230.26 g/mol
Molecular Formula C14H14O3
Exact Mass 230.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HPq9uxiAYqQ
Name Spiro[2H-1-benzopyran-2,2'(5'H)-furan]-4(3H)-one, 3',5'-dimethyl-, trans-(.+-.)-
Alternate Name(s) (2S,5'S)-3',5'-dimethyl-3,4-dihydro-5'H-spiro[1-benzopyran-2,2'-furan]-4-one Diastereoisomer of spiro[4-chromanone-2,2'-(3',5'-dimethyl-2',5'-dihydrofuran)]
CAS Registry Number 86648-98-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14O3
InChI InChI=1S/C14H14O3/c1-9-7-10(2)16-14(9)8-12(15)11-5-3-4-6-13(11)17-14/h3-7,10H,8H2,1-2H3/t10-,14-/m0/s1
InChIKey MLACTXCGUUXTOT-HZMBPMFUSA-N
Molecular Weight 230.263 g/mol
SMILES [C@@]12(Oc3ccccc3C(C2)=O)C(=C[C@@](O1)(C)[H])C
SPLASH splash10-075d-7920000000-1c662e84778eabbb477b
Source of Spectrum H-66-599-0
Wiley ID 1231965