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4-(1-propenyl)-5,9-dimethyl-5-(N-methyl-N-(1'-methoxycarbonyl-2'-hydroxyethyl)-carbamoylmethylcarbonyl)-bicyclo[4.4.0]dec-2-ene
SpectraBase Compound ID CrJMY03HU3
InChI InChI=1S/C23H35NO5/c1-6-7-17-10-9-16-12-15(2)8-11-18(16)23(17,3)20(26)13-21(27)24(4)19(14-25)22(28)29-5/h6-7,9-10,15-19,25H,8,11-14H2,1-5H3/b7-6+
InChIKey BKICHZUXDKGZGO-VOTSOKGWSA-N
Mol Weight 405.5 g/mol
Molecular Formula C23H35NO5
Exact Mass 405.251523 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Duxhu3dMSoA
Name 4-(1-propenyl)-5,9-dimethyl-5-(N-methyl-N-(1'-methoxycarbonyl-2'-hydroxyethyl)-carbamoylmethylcarbonyl)-bicyclo[4.4.0]dec-2-ene
Alternate Name(s) Methyl 2-[(3-{1,6-dimethyl-2-[(1E)-1-propenyl]-1,2,4a,5,6,7,8,8a-octahydro-1-naphthalenyl}-3-oxopropanoyl)(methyl)amino]-3-hydroxypropanoate
CAS Registry Number 122999-77-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H35NO5
InChI InChI=1S/C23H35NO5/c1-6-7-17-10-9-16-12-15(2)8-11-18(16)23(17,3)20(26)13-21(27)24(4)19(14-25)22(28)29-5/h6-7,9-10,15-19,25H,8,11-14H2,1-5H3/b7-6+
InChIKey BKICHZUXDKGZGO-VOTSOKGWSA-N
Molecular Weight 405.535 g/mol
SMILES OCC(N(C(CC(C1(C2C(CC(CC2)C)C=CC1\C=C\C)C)=O)=O)C)C(=O)OC
SPLASH splash10-001i-2940000000-18d57d27905a43c60ba1
Source of Spectrum C-111-8235-0
Wiley ID 1371774