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Pent-4-enoic acid, 2-(1-tert-butoxycarbonyl-3-indolylmethyl)-, methyl ester
SpectraBase Compound ID 4W5Nd41OFfS
InChI InChI=1S/C20H25NO4/c1-6-9-14(18(22)24-5)12-15-13-21(19(23)25-20(2,3)4)17-11-8-7-10-16(15)17/h6-8,10-11,13-14H,1,9,12H2,2-5H3
InChIKey RUNXZSBKSUAZLH-UHFFFAOYSA-N
Mol Weight 343.42 g/mol
Molecular Formula C20H25NO4
Exact Mass 343.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Bhx1OfMjhq
Name Pent-4-enoic acid, 2-(1-tert-butoxycarbonyl-3-indolylmethyl)-, methyl ester
Alternate Name(s) 3-(2-carbomethoxypent-4-enyl)indole-1-carboxylic acid tert-butyl ester 3-(2-Methoxycarbonylpent-4-enyl)-1-indolecarboxylic acid tert-butyl ester tert-Butyl 3-(2-methoxycarbonylpent-4-enyl)indole-1-carboxylate tert-Butyl 3-[2-(methoxycarbonyl)-4-pentenyl]-1H-indole-1-carboxylate
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Formula C20H25NO4
InChI InChI=1S/C20H25NO4/c1-6-9-14(18(22)24-5)12-15-13-21(19(23)25-20(2,3)4)17-11-8-7-10-16(15)17/h6-8,10-11,13-14H,1,9,12H2,2-5H3
InChIKey RUNXZSBKSUAZLH-UHFFFAOYSA-N
Molecular Weight 343.423 g/mol
SMILES c1(c[n](c2ccccc12)C(OC(C)(C)C)=O)CC(C(OC)=O)CC=C
SPLASH splash10-053r-6920000000-8a06032349e8fdaee7bb
Source of Spectrum AD-0-2532-0
Wiley ID 1426021