1H,3H-Pyrrolo[1,2-c]oxazole, 4-pentenoic acid deriv.

SpectraBase Compound ID	Ie0L5gNigNy
InChI	InChI=1S/C18H27NO4/c1-6-8-9-14(20)22-13-11-18(10-7-2)16(21)23-15(17(3,4)5)19(18)12-13/h6-7,13,15H,1-2,8-12H2,3-5H3/t13-,15+,18+/m0/s1
InChIKey	KMHKGCUROKZRLU-JCKWVBRZSA-N Google Search
Mol Weight	321.42 g/mol
Molecular Formula	C18H27NO4
Exact Mass	321.194008 g/mol

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SpectraBase Spectrum ID	5szVCd5IKeu
Name	1H,3H-Pyrrolo[1,2-c]oxazole, 4-pentenoic acid deriv.
Alternate Name(s)	4-Pentenoic acid, 3-(1,1-dimethylethyl)tetrahydro-1-oxo-7a-(2-propenyl)-1H,3H-pyrrolo[1,2-c]oxazol-6-yl ester, [3R-(3.alpha.,6.alpha.,7a.alpha.)]- (3R,6S,7aR)-7a-allyl-3-tert-butyl-1-oxotetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-6-yl 4-pentenoate 4-Pentensaure-[(2R,5S,7R)-5-allyl-2-(tert-butyl)-4-oxo-3-oxa-1-azabicyclo[3.3.0]oct-7-yl]ester
CAS Registry Number	97652-04-5
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C18H27NO4
InChI	InChI=1S/C18H27NO4/c1-6-8-9-14(20)22-13-11-18(10-7-2)16(21)23-15(17(3,4)5)19(18)12-13/h6-7,13,15H,1-2,8-12H2,3-5H3/t13-,15+,18+/m0/s1
InChIKey	KMHKGCUROKZRLU-JCKWVBRZSA-N
Molecular Weight	321.417 g/mol
SMILES	[C@]12(N([C@](OC2=O)(C(C)(C)C)[H])C[C@](C1)(OC(=O)CCC=C)[H])CC=C
SPLASH	splash10-053f-6910000000-1321c10f0e701348847a
Source of Spectrum	H-68-159-6
Wiley ID	1320950