CID 54689811

19225-12-8

Structural Information

Molecular Formula
C19H26N2O4
SMILES
CCCN(CCC)CCNC(=O)C1=C(C2=CC=CC(=C2OC1=O)C)O
InChI
InChI=1S/C19H26N2O4/c1-4-10-21(11-5-2)12-9-20-18(23)15-16(22)14-8-6-7-13(3)17(14)25-19(15)24/h6-8,22H,4-5,9-12H2,1-3H3,(H,20,23)
InChIKey
HWHOAUJTMQFIMS-UHFFFAOYSA-N
Compound name
N-[2-(dipropylamino)ethyl]-4-hydroxy-8-methyl-2-oxochromene-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

346.18927 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.19655 184.9
[M+Na]+ 369.17849 191.0
[M-H]- 345.18199 189.9
[M+NH4]+ 364.22309 197.7
[M+K]+ 385.15243 189.3
[M+H-H2O]+ 329.18653 176.7
[M+HCOO]- 391.18747 206.0
[M+CH3COO]- 405.20312 221.8
[M+Na-2H]- 367.16394 187.3
[M]+ 346.18872 190.8
[M]- 346.18982 190.8
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

No patent data available for this compound.