3-{[(E)-(6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl)methylidene]amino}-9-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione

SpectraBase Compound ID	8yYoiBIJGBV
InChI	InChI=1S/C21H22N4O3/c1-21(2)12-8-7-11(13(21)9-12)10-22-25-19(26)18-17(24-20(25)27)16-14(23-18)5-4-6-15(16)28-3/h4-7,10,12-13,23H,8-9H2,1-3H3,(H,24,27)/b22-10+
InChIKey	NYSNJBQMKSVCSG-LSHDLFTRSA-N Google Search
Mol Weight	378.43 g/mol
Molecular Formula	C21H22N4O3
Exact Mass	378.169191 g/mol

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SpectraBase Spectrum ID	AdzZpfQn6aK
Name	3-{[(E)-(6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl)methylidene]amino}-9-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C21H22N4O3/c1-21(2)12-8-7-11(13(21)9-12)10-22-25-19(26)18-17(24-20(25)27)16-14(23-18)5-4-6-15(16)28-3/h4-7,10,12-13,23H,8-9H2,1-3H3,(H,24,27)/b22-10+
InChIKey	NYSNJBQMKSVCSG-LSHDLFTRSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_18226
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: D32080; Labnumber: SIMAK-01547; SBI_ID: SBI-018229
Synonyms	3-{[(6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl)methylidene]amino}-9-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Temperature	308 °C