CID 38104

38835-17-5

Structural Information

Molecular Formula
C17H20O5
SMILES
CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)OCC(CO)O
InChI
InChI=1S/C17H20O5/c1-11(17(20)22-10-15(19)9-18)12-3-4-14-8-16(21-2)6-5-13(14)7-12/h3-8,11,15,18-19H,9-10H2,1-2H3
InChIKey
NQGWSPZQESAHBV-UHFFFAOYSA-N
Compound name
2,3-dihydroxypropyl 2-(6-methoxynaphthalen-2-yl)propanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

304.13107 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.13835 169.6
[M+Na]+ 327.12029 180.2
[M+NH4]+ 322.16489 175.6
[M+K]+ 343.09423 175.7
[M-H]- 303.12379 169.6
[M+Na-2H]- 325.10574 172.8
[M]+ 304.13052 170.8
[M]- 304.13162 170.8
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