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2-Benzofurancarboxylic acid, 3a,4,7,7a-tetrahydro-, methyl ester, cis-
SpectraBase Compound ID 2iE5mEz0KOo
InChI InChI=1S/C10H12O3/c1-12-10(11)9-6-7-4-2-3-5-8(7)13-9/h2-3,6-8H,4-5H2,1H3/t7-,8-/m0/s1
InChIKey LMVLJMMWHSYILA-YUMQZZPRSA-N
Mol Weight 180.2 g/mol
Molecular Formula C10H12O3
Exact Mass 180.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9kRtkRhGw5T
Name 2-Benzofurancarboxylic acid, 3a,4,7,7a-tetrahydro-, methyl ester, cis-
Alternate Name(s) Methyl (3aS,7aS)-3a,4,7,7a-tetrahydro-1-benzofuran-2-carboxylate
CAS Registry Number 117252-27-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O3
InChI InChI=1S/C10H12O3/c1-12-10(11)9-6-7-4-2-3-5-8(7)13-9/h2-3,6-8H,4-5H2,1H3/t7-,8-/m0/s1
InChIKey LMVLJMMWHSYILA-YUMQZZPRSA-N
Molecular Weight 180.203 g/mol
SMILES C=1(O[C@]2(CC=CC[C@]2(C1)[H])[H])C(=O)OC
SPLASH splash10-004i-9100000000-2ad265e00d464c5e730c
Source of Spectrum J-53-5852-4
Wiley ID 1176237