CID 56202

91246-67-2

Structural Information

Molecular Formula
C11H15NO2
SMILES
CN(C)CC1COC2=CC=CC=C2O1
InChI
InChI=1S/C11H15NO2/c1-12(2)7-9-8-13-10-5-3-4-6-11(10)14-9/h3-6,9H,7-8H2,1-2H3
InChIKey
XVMGCHPAEHYBAP-UHFFFAOYSA-N
Compound name
1-(2,3-dihydro-1,4-benzodioxin-3-yl)-N,N-dimethylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

193.11028 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.11756 141.8
[M+Na]+ 216.09950 148.1
[M-H]- 192.10300 148.5
[M+NH4]+ 211.14410 160.0
[M+K]+ 232.07344 149.6
[M+H-H2O]+ 176.10754 135.1
[M+HCOO]- 238.10848 162.8
[M+CH3COO]- 252.12413 189.1
[M+Na-2H]- 214.08495 150.7
[M]+ 193.10973 143.3
[M]- 193.11083 143.3
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

patents stripe