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

20
Patents

193.11028 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.117556 141.8
[M+Na]+ 216.099498 148.1
[M-H]- 192.103004 148.5
[M+NH4]+ 211.144103 160.0
[M+K]+ 232.073438 149.6
[M+H-H2O]+ 176.107540 135.1
[M+HCOO]- 238.108481 162.8
[M+CH3COO]- 252.124131 189.1
[M+Na-2H]- 214.084946 150.7
[M]+ 193.10973142 143.3
[M]- 193.11082858 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