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Spiro[cyclopentane-1,8'-[4H-1,12]methano[8H][1,7]dioxacyclododecino[4,3-b]pyrrole]-6',10'(7'H,9'H)-dione, 2',3',3'a,12',13',13'a-hexahydro-, [3'aR-(3'aR*,12'R*,13'aR*)]-
SpectraBase Compound ID JaN3yLZXPGY
InChI InChI=1S/C17H25NO4/c19-16-6-11-2-1-3-12(11)7-17(20)22-14-8-15-13(10-21-16)4-5-18(15)9-14/h11-15H,1-10H2/t11?,12?,13-,14+,15+/m0/s1
InChIKey NVXQXGBPIJIYLF-MMCPYJTDSA-N
Mol Weight 307.39 g/mol
Molecular Formula C17H25NO4
Exact Mass 307.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B9yInrLh6I5
Name Spiro[cyclopentane-1,8'-[4H-1,12]methano[8H][1,7]dioxacyclododecino[4,3-b]pyrrole]-6',10'(7'H,9'H)-dione, 2',3',3'a,12',13',13'a-hexahydro-, [3'aR-(3'aR*,12'R*,13'aR*)]-
CAS Registry Number 125038-85-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H25NO4
InChI InChI=1S/C17H25NO4/c19-16-6-11-2-1-3-12(11)7-17(20)22-14-8-15-13(10-21-16)4-5-18(15)9-14/h11-15H,1-10H2/t11?,12?,13-,14+,15+/m0/s1
InChIKey NVXQXGBPIJIYLF-MMCPYJTDSA-N
Molecular Weight 307.390 g/mol
SMILES [C@@]12(N3CC[C@]1(COC(CC1C(CC(O[C@](C2)(C3)[H])=O)CCC1)=O)[H])[H]
SPLASH splash10-00di-0900000000-5adfe22e98714c044d17
Source of Spectrum KC-1989-1341-11
Synonyms (-)-(1R,6R,8R)-6,9-O,O-(3,3-tetramethyleneglutaryl)-6-hydroxy-1-hydroxymethylpyrrolizidine (4R,17R,19R)-6,16-dioxa-1-azatetracyclo[15.2.1.0(4,19).0(9,13)]icosane-7,15-dione
Wiley ID 1308980