CID 26142

2795 i.s.

Structural Information

Molecular Formula
C14H21NO4
SMILES
CN(CCOC)CC(C1COC2=CC=CC=C2O1)O
InChI
InChI=1S/C14H21NO4/c1-15(7-8-17-2)9-11(16)14-10-18-12-5-3-4-6-13(12)19-14/h3-6,11,14,16H,7-10H2,1-2H3
InChIKey
PDIOFRZUYUBDMI-UHFFFAOYSA-N
Compound name
1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[2-methoxyethyl(methyl)amino]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

267.14706 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.154336 162.8
[M+Na]+ 290.136278 166.8
[M-H]- 266.139784 167.5
[M+NH4]+ 285.180883 176.9
[M+K]+ 306.110218 168.3
[M+H-H2O]+ 250.144320 155.3
[M+HCOO]- 312.145261 180.6
[M+CH3COO]- 326.160911 200.8
[M+Na-2H]- 288.121726 168.4
[M]+ 267.14651142 165.7
[M]- 267.14760858 165.7
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.