CID 100527

62669-74-3

Structural Information

Molecular Formula
C14H15NO2
SMILES
CN(C)C1=CC2=C(C=C1)C3=C(CCC3)C(=O)O2
InChI
InChI=1S/C14H15NO2/c1-15(2)9-6-7-11-10-4-3-5-12(10)14(16)17-13(11)8-9/h6-8H,3-5H2,1-2H3
InChIKey
RIUSGHALMCFISX-UHFFFAOYSA-N
Compound name
7-(dimethylamino)-2,3-dihydro-1H-cyclopenta[c]chromen-4-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

1432
Patents

229.11028 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.11756 148.3
[M+Na]+ 252.09950 157.6
[M-H]- 228.10300 156.3
[M+NH4]+ 247.14410 169.8
[M+K]+ 268.07344 156.0
[M+H-H2O]+ 212.10754 142.4
[M+HCOO]- 274.10848 171.4
[M+CH3COO]- 288.12413 162.6
[M+Na-2H]- 250.08495 154.8
[M]+ 229.10973 151.3
[M]- 229.11083 151.3
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