Cas no 129681-31-8 (5H-2,4a-Methano-4H-1,3-benzoxazin-4-one,2,3,8,8a-tetrahydro-8,9-dihydroxy-3-methoxy-2-methyl-5-(1-propenyl)- (9CI))
129681-31-8 structure
Product Name:5H-2,4a-Methano-4H-1,3-benzoxazin-4-one,2,3,8,8a-tetrahydro-8,9-dihydroxy-3-methoxy-2-methyl-5-(1-propenyl)- (9CI)
CAS No:129681-31-8
MF:C14H19NO5
MW:281.304364442825
CID:219635
Update Time:2024-03-01
5H-2,4a-Methano-4H-1,3-benzoxazin-4-one,2,3,8,8a-tetrahydro-8,9-dihydroxy-3-methoxy-2-methyl-5-(1-propenyl)- (9CI) Chemical and Physical Properties
Names and Identifiers
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- 5H-2,4a-Methano-4H-1,3-benzoxazin-4-one,2,3,8,8a-tetrahydro-8,9-dihydroxy-3-methoxy-2-methyl-5-(1-propenyl)- (9CI)
- Spirostaphylotrichine T
- SpirostaphylotrichinT
-
- Inchi： 1S/C14H19NO5/c1-4-5-8-6-7-9(16)10-14(8)11(17)13(2,20-10)15(19-3)12(14)18/h4-11,16-17H,1-3H3/b5-4+
- InChI Key： UYPHRYQQVRKGSZ-SNAWJCMRSA-N
- SMILES： O1C2C(O)C=CC(/C=C/C)C32C(O)C1(C)N(OC)C3=O
Computed Properties
- Exact Mass: 272.08309
Experimental Properties
- PSA: 52.54
5H-2,4a-Methano-4H-1,3-benzoxazin-4-one,2,3,8,8a-tetrahydro-8,9-dihydroxy-3-methoxy-2-methyl-5-(1-propenyl)- (9CI) Related Literature
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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4. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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