CID 41833

2-(2-(3-(dimethylamino)propoxy)ethyl)-2-methyl-1,3-benzodioxole hydrochloride

Structural Information

Molecular Formula
C15H23NO3
SMILES
CC1(OC2=CC=CC=C2O1)CCOCCCN(C)C
InChI
InChI=1S/C15H23NO3/c1-15(9-12-17-11-6-10-16(2)3)18-13-7-4-5-8-14(13)19-15/h4-5,7-8H,6,9-12H2,1-3H3
InChIKey
FEICGMWWIYYVCD-UHFFFAOYSA-N
Compound name
N,N-dimethyl-3-[2-(2-methyl-1,3-benzodioxol-2-yl)ethoxy]propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

265.1678 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.17508 162.2
[M+Na]+ 288.15702 172.8
[M+NH4]+ 283.20162 171.6
[M+K]+ 304.13096 166.8
[M-H]- 264.16052 167.1
[M+Na-2H]- 286.14247 167.1
[M]+ 265.16725 165.3
[M]- 265.16835 165.3
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