CID 287144

Nsc146556

Structural Information

Molecular Formula
C19H17NO6
SMILES
CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)NC3=C(C=C(C=C3)OC)OC
InChI
InChI=1S/C19H17NO6/c1-11-8-18(21)26-16-10-13(4-6-14(11)16)25-19(22)20-15-7-5-12(23-2)9-17(15)24-3/h4-10H,1-3H3,(H,20,22)
InChIKey
UMFISGXXMWLFEH-UHFFFAOYSA-N
Compound name
(4-methyl-2-oxochromen-7-yl) N-(2,4-dimethoxyphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

355.1056 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 356.11288 180.2
[M+Na]+ 378.09482 189.3
[M-H]- 354.09832 189.5
[M+NH4]+ 373.13942 192.6
[M+K]+ 394.06876 188.3
[M+H-H2O]+ 338.10286 171.0
[M+HCOO]- 400.10380 203.1
[M+CH3COO]- 414.11945 216.9
[M+Na-2H]- 376.08027 185.4
[M]+ 355.10505 188.0
[M]- 355.10615 188.0
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.