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Spiro[cyclohexane-1,1'(4'H)-pyrrolo[3,4-c]pyrrole]-4',6'(5'H)-dione, 3'a,6'a-dihydro-5'-methyl-3'-phenyl-, cis-
SpectraBase Compound ID 6uOzocylZoB
InChI InChI=1S/C18H20N2O2/c1-20-16(21)13-14(17(20)22)18(10-6-3-7-11-18)19-15(13)12-8-4-2-5-9-12/h2,4-5,8-9,13-14H,3,6-7,10-11H2,1H3/t13-,14-/m0/s1
InChIKey XLCIFTJFAJOPHA-KBPBESRZSA-N
Mol Weight 296.37 g/mol
Molecular Formula C18H20N2O2
Exact Mass 296.152478 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cuy4M3dhfAK
Name Spiro[cyclohexane-1,1'(4'H)-pyrrolo[3,4-c]pyrrole]-4',6'(5'H)-dione, 3'a,6'a-dihydro-5'-methyl-3'-phenyl-, cis-
Alternate Name(s) (3'aS,6'aR)-5'-methyl-3'-phenyl-4',5',6',6'a-tetrahydro-3'aH-spiro[cyclohexane-1,1'-pyrrolo[3,4-c]pyrrole]-4',6'-dione Spiro[cyclohexyl,1-3',-3'a,4',6',6'a-tetrahydro-5'-methyl-3'h-1'-phenylpyrrolo[3',4'-c]pyrrol-4',6'-dione]
CAS Registry Number 107554-68-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20N2O2
InChI InChI=1S/C18H20N2O2/c1-20-16(21)13-14(17(20)22)18(10-6-3-7-11-18)19-15(13)12-8-4-2-5-9-12/h2,4-5,8-9,13-14H,3,6-7,10-11H2,1H3/t13-,14-/m0/s1
InChIKey XLCIFTJFAJOPHA-KBPBESRZSA-N
Molecular Weight 296.370 g/mol
SMILES [C@@]12([C@@](C(=O)N(C2=O)C)(C2(CCCCC2)N=C1c1ccccc1)[H])[H]
SPLASH splash10-0a4i-0910000000-5e6146221f9a179b1016
Source of Spectrum AJ-59-1820-33
Wiley ID 1299362