CID 136319

Chroman

Structural Information

Molecular Formula

C₉H₁₀O

SMILES

C1CC2=CC=CC=C2OC1

InChI

InChI=1S/C9H10O/c1-2-6-9-8(4-1)5-3-7-10-9/h1-2,4,6H,3,5,7H2

InChIKey

VZWXIQHBIQLMPN-UHFFFAOYSA-N

Compound name

3,4-dihydro-2H-chromene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 145
References: 64396
Patents: 134.07317 Da
Monoisotopic Mass: 2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	135.08045	124.6
[M+Na]+	157.06239	138.9
[M+NH4]+	152.10699	135.6
[M+K]+	173.03633	131.4
[M-H]-	133.06589	129.9
[M+Na-2H]-	155.04784	132.5
[M]+	134.07262	128.3
[M]-	134.07372	128.3

Literature stripe

literature stripe

Patent stripe

patents stripe