CID 59203

Carbanilic acid, p-(2-morpholinoethoxy)-, 2-butoxyethyl ester, hydrochloride

Structural Information

Molecular Formula
C19H30N2O5
SMILES
CCCCOCCOC(=O)NC1=CC=C(C=C1)OCCN2CCOCC2
InChI
InChI=1S/C19H30N2O5/c1-2-3-11-23-15-16-26-19(22)20-17-4-6-18(7-5-17)25-14-10-21-8-12-24-13-9-21/h4-7H,2-3,8-16H2,1H3,(H,20,22)
InChIKey
HRIUQUNVFARROT-UHFFFAOYSA-N
Compound name
2-butoxyethyl N-[4-(2-morpholin-4-ylethoxy)phenyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

366.21548 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.22276 189.1
[M+Na]+ 389.20470 190.1
[M-H]- 365.20820 192.8
[M+NH4]+ 384.24930 197.6
[M+K]+ 405.17864 189.3
[M+H-H2O]+ 349.21274 178.6
[M+HCOO]- 411.21368 206.4
[M+CH3COO]- 425.22933 215.9
[M+Na-2H]- 387.19015 191.1
[M]+ 366.21493 192.0
[M]- 366.21603 192.0
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.