CID 10442498

3h-spiro[2-benzofuran-1,4'-piperidine] hydrochloride

Structural Information

Molecular Formula
C12H15NO
SMILES
C1CNCCC12C3=CC=CC=C3CO2
InChI
InChI=1S/C12H15NO/c1-2-4-11-10(3-1)9-14-12(11)5-7-13-8-6-12/h1-4,13H,5-9H2
InChIKey
BYOIMOJOKVUNTP-UHFFFAOYSA-N
Compound name
spiro[1H-2-benzofuran-3,4'-piperidine]
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

999
Patents

189.11537 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.122646 141.1
[M+Na]+ 212.104588 147.3
[M-H]- 188.108094 144.9
[M+NH4]+ 207.149193 162.1
[M+K]+ 228.078528 144.4
[M+H-H2O]+ 172.112630 134.3
[M+HCOO]- 234.113571 157.6
[M+CH3COO]- 248.129221 153.1
[M+Na-2H]- 210.090036 148.2
[M]+ 189.11482142 135.0
[M]- 189.11591858 135.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe