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]+ 268.15434 162.8
[M+Na]+ 290.13628 166.8
[M-H]- 266.13978 167.5
[M+NH4]+ 285.18088 176.9
[M+K]+ 306.11022 168.3
[M+H-H2O]+ 250.14432 155.3
[M+HCOO]- 312.14526 180.6
[M+CH3COO]- 326.16091 200.8
[M+Na-2H]- 288.12173 168.4
[M]+ 267.14651 165.7
[M]- 267.14761 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.