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]+ 188.10700 139.5
[M+Na]+ 210.08894 146.8
[M-H]- 186.09244 143.7
[M+NH4]+ 205.13354 160.7
[M+K]+ 226.06288 143.6
[M+H-H2O]+ 170.09698 132.7
[M+HCOO]- 232.09792 157.4
[M+CH3COO]- 246.11357 152.0
[M+Na-2H]- 208.07439 147.6
[M]+ 187.09917 134.8
[M]- 187.10027 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