CID 68552130

Spiro[chromene-2,3'-pyrrolidine] hydrochloride

Structural Information

Molecular Formula

C₁₂H₁₃NO

SMILES

C1CNCC12C=CC3=CC=CC=C3O2

InChI

InChI=1S/C12H13NO/c1-2-4-11-10(3-1)5-6-12(14-11)7-8-13-9-12/h1-6,13H,7-9H2

InChIKey

CXYUYMGDCIRGNO-UHFFFAOYSA-N

Compound name

spiro[chromene-2,3'-pyrrolidine]

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 187.09972 Da
Monoisotopic Mass: 2.3
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]+	188.10700	141.0
[M+Na]+	210.08894	153.9
[M+NH4]+	205.13354	152.5
[M+K]+	226.06288	146.5
[M-H]-	186.09244	145.7
[M+Na-2H]-	208.07439	148.7
[M]+	187.09917	144.4
[M]-	187.10027	144.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe