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(phenylmethyl) N-[(3aS,7R,8aS)-2,2-dimethyl-5-oxidanylidene-3a,4,6,7,8,8a-hexahydrocyclohepta[d][1,3]dioxol-7-yl]carbamate
SpectraBase Compound ID 44LGGyYM22N
InChI InChI=1S/C18H23NO5/c1-18(2)23-15-9-13(8-14(20)10-16(15)24-18)19-17(21)22-11-12-6-4-3-5-7-12/h3-7,13,15-16H,8-11H2,1-2H3,(H,19,21)/t13-,15-,16-/m0/s1
InChIKey VJXCUZMVYRNULS-BPUTZDHNSA-N
Mol Weight 333.38 g/mol
Molecular Formula C18H23NO5
Exact Mass 333.157623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 79qSFULvQTL
Name (phenylmethyl) N-[(3aS,7R,8aS)-2,2-dimethyl-5-oxidanylidene-3a,4,6,7,8,8a-hexahydrocyclohepta[d][1,3]dioxol-7-yl]carbamate
Alternate Name(s) benzyl N-[(3aS,7R,8aS)-2,2-dimethyl-5-oxo-3a,4,6,7,8,8a-hexahydrocyclohepta[d][1,3]dioxol-7-yl]carbamate N-[(3aS,7R,8aS)-2,2-dimethyl-5-oxo-3a,4,6,7,8,8a-hexahydrocyclohepta[d][1,3]dioxol-7-yl]carbamic acid (phenylmethyl) ester N-[(3aS,7R,8aS)-5-keto-2,2-dimethyl-3a,4,6,7,8,8a-hexahydrocyclohepta[d][1,3]dioxol-7-yl]carbamic acid benzyl ester
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Formula C18H23NO5
InChI InChI=1S/C18H23NO5/c1-18(2)23-15-9-13(8-14(20)10-16(15)24-18)19-17(21)22-11-12-6-4-3-5-7-12/h3-7,13,15-16H,8-11H2,1-2H3,(H,19,21)/t13-,15-,16-/m0/s1
InChIKey VJXCUZMVYRNULS-BPUTZDHNSA-N
Molecular Weight 333.384 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@@]1(C[C@@]2(OC(O[C@]2(CC(C1)=O)[H])(C)C)[H])[H]
SPLASH splash10-0006-9210000000-f707047e5ad7ee125254
Source of Spectrum J-60-622-33
Wiley ID 1330230