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

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.106996 139.5
[M+Na]+ 210.088938 146.8
[M-H]- 186.092444 143.7
[M+NH4]+ 205.133543 160.7
[M+K]+ 226.062878 143.6
[M+H-H2O]+ 170.096980 132.7
[M+HCOO]- 232.097921 157.4
[M+CH3COO]- 246.113571 152.0
[M+Na-2H]- 208.074386 147.6
[M]+ 187.09917142 134.8
[M]- 187.10026858 134.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe