CID 11550684

845276-38-2

Structural Information

Molecular Formula
C15H18O4
SMILES
COC1=C(C2=C(C=CC(O2)C3CC3)C(=C1)CO)OC
InChI
InChI=1S/C15H18O4/c1-17-13-7-10(8-16)11-5-6-12(9-3-4-9)19-14(11)15(13)18-2/h5-7,9,12,16H,3-4,8H2,1-2H3
InChIKey
PGNVWUKZOFCMFC-UHFFFAOYSA-N
Compound name
(2-cyclopropyl-7,8-dimethoxy-2H-chromen-5-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

262.1205 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.12778 158.8
[M+Na]+ 285.10972 173.8
[M+NH4]+ 280.15432 167.7
[M+K]+ 301.08366 168.8
[M-H]- 261.11322 170.4
[M+Na-2H]- 283.09517 166.6
[M]+ 262.11995 165.4
[M]- 262.12105 165.4
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