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1,3-Isobenzofurandione, 5-[(diphenylphosphinyl)phenylmethyl]-3a,4,7,7a-tetrahydro-
SpectraBase Compound ID vq7DMfZBig
InChI InChI=1S/C27H23O4P/c28-26-23-17-16-20(18-24(23)27(29)31-26)25(19-10-4-1-5-11-19)32(30,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-16,23-25H,17-18H2
InChIKey ZOAOCDHGXOYQAP-UHFFFAOYSA-N
Mol Weight 442.45 g/mol
Molecular Formula C27H23O4P
Exact Mass 442.133396 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzyLFXNDEhs
Name 1,3-Isobenzofurandione, 5-[(diphenylphosphinyl)phenylmethyl]-3a,4,7,7a-tetrahydro-
CAS Registry Number 64894-24-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H23O4P
InChI InChI=1S/C27H23O4P/c28-26-23-17-16-20(18-24(23)27(29)31-26)25(19-10-4-1-5-11-19)32(30,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-16,23-25H,17-18H2
InChIKey ZOAOCDHGXOYQAP-UHFFFAOYSA-N
Molecular Weight 442.451 g/mol
SMILES C1(OC(C2CC=C(CC12)C(P(=O)(c1ccccc1)c1ccccc1)c1ccccc1)=O)=O
SPLASH splash10-0uxr-0090100000-e437fde41b51cf9f00ad
Source of Spectrum KC-1977-1460-0
Synonyms 4-(.alpha.-diphenylphosphinoylbenzyl)cyclohex-ene-1,2-dicarboxylic-anhydride 5-[(diphenylphosphoryl)(phenyl)methyl]-3a,4,7,7a-tetrahydro-2-benzofuran-1,3-dione
Wiley ID 1385430