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Pyrano[3,4-b]indol-3(9H)-one, 1-(6-heptynyl)-
SpectraBase Compound ID FPwnP9OUbAY
InChI InChI=1S/C18H17NO2/c1-2-3-4-5-6-11-16-18-14(12-17(20)21-16)13-9-7-8-10-15(13)19-18/h1,7-10,12,19H,3-6,11H2
InChIKey SXMVPJNWSCRBKW-UHFFFAOYSA-N
Mol Weight 279.34 g/mol
Molecular Formula C18H17NO2
Exact Mass 279.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ddfgpeo33Xr
Name Pyrano[3,4-b]indol-3(9H)-one, 1-(6-heptynyl)-
CAS Registry Number 116705-65-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17NO2
InChI InChI=1S/C18H17NO2/c1-2-3-4-5-6-11-16-18-14(12-17(20)21-16)13-9-7-8-10-15(13)19-18/h1,7-10,12,19H,3-6,11H2
InChIKey SXMVPJNWSCRBKW-UHFFFAOYSA-N
Molecular Weight 279.339 g/mol
SMILES N1c2ccccc2C=2C1=C(OC(C2)=O)CCCCCC#C
SPLASH splash10-005a-0690000000-d5c9e8fc748dd5fae31d
Source of Spectrum KC-1988-3253-5
Synonyms 1-(6-heptynyl)pyrano[3,4-b]indol-3(9H)-one 1-(hept-6-ynyl)pyrano[3,4-b]indol-3-one
Wiley ID 1283175